USER MOD reduce.3.24.130724 H: found=0, std=0, add=868, rem=0, adj=15 USER MOD reduce.3.24.130724 removed 869 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 692 HIS : no HD1:sc= -1.18 K(o=-1.2,f=-5!) USER MOD Set 1.2: A 696 HIS : no HD1:sc= -0.018 K(o=-1.2,f=-2.3) USER MOD Set 2.1: A 661 SER OG : rot 180:sc= -0.0304 USER MOD Set 2.2: A 685 SER OG : rot 140:sc= 0.337 USER MOD Single : A 629 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 641 THR OG1 : rot 102:sc= 0.722 USER MOD Single : A 644 CYS SG : rot 93:sc= 0.947 USER MOD Single : A 646 MET CE :methyl 152:sc= -1.05 (180deg=-2.74!) USER MOD Single : A 648 THR OG1 : rot 66:sc= 0.289! USER MOD Single : A 653 LYS NZ :NH3+ -157:sc= -0.0502 (180deg=-0.521) USER MOD Single : A 662 THR OG1 : rot -170:sc= -0.693 USER MOD Single : A 666 GLN : amide:sc= -0.0102 K(o=-0.01,f=-1.4) USER MOD Single : A 671 GLN : amide:sc= -0.132 K(o=-0.13,f=-1.1!) USER MOD Single : A 677 MET CE :methyl 156:sc= -3.69 (180deg=-5.87!) USER MOD Single : A 684 GLN : amide:sc=-0.00106 K(o=-0.0011,f=-1.7!) USER MOD Single : A 686 CYS SG : rot 170:sc= -0.681 USER MOD Single : A 691 GLN : amide:sc= 0 K(o=0,f=-1.3!) USER MOD Single : A 718 THR OG1 : rot 180:sc= 0 USER MOD Single : A 720 GLN : amide:sc= 0 K(o=0,f=-1.4!) USER MOD Single : A 722 SER OG : rot -100:sc= -1.59 USER MOD Single : A 726 SER OG : rot 180:sc= 0 USER MOD Single : A 727 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 732 GLN : amide:sc= 0 K(o=0,f=-0.91) USER MOD Single : A 736 THR OG1 : rot 73:sc= 0.731 USER MOD Single : A 737 THR OG1 : rot 72:sc= 0.0614 USER MOD Single : A 739 GLN : amide:sc= -2.34! C(o=-2.3!,f=-3.8!) USER MOD ----------------------------------------------------------------- ATOM 13 N GLY A 628 -7.311 7.484 9.385 1.00 0.00 N ATOM 14 CA GLY A 628 -7.873 6.749 8.259 1.00 0.00 C ATOM 15 C GLY A 628 -7.202 7.153 6.952 1.00 0.00 C ATOM 16 O GLY A 628 -7.792 7.032 5.879 1.00 0.00 O ATOM 0 HA2 GLY A 628 -7.748 5.678 8.420 1.00 0.00 H new ATOM 0 HA3 GLY A 628 -8.945 6.938 8.195 1.00 0.00 H new ATOM 20 N HIS A 629 -5.965 7.631 7.046 1.00 0.00 N ATOM 21 CA HIS A 629 -5.231 8.044 5.857 1.00 0.00 C ATOM 22 C HIS A 629 -4.435 6.871 5.300 1.00 0.00 C ATOM 23 O HIS A 629 -3.698 6.208 6.029 1.00 0.00 O ATOM 24 CB HIS A 629 -4.282 9.196 6.196 1.00 0.00 C ATOM 25 CG HIS A 629 -5.064 10.330 6.800 1.00 0.00 C ATOM 26 ND1 HIS A 629 -5.867 11.163 6.036 1.00 0.00 N ATOM 27 CD2 HIS A 629 -5.179 10.781 8.092 1.00 0.00 C ATOM 28 CE1 HIS A 629 -6.424 12.063 6.866 1.00 0.00 C ATOM 29 NE2 HIS A 629 -6.039 11.875 8.131 1.00 0.00 N ATOM 0 H HIS A 629 -5.455 7.741 7.923 1.00 0.00 H new ATOM 0 HA HIS A 629 -5.945 8.381 5.106 1.00 0.00 H new ATOM 0 HB2 HIS A 629 -3.516 8.857 6.893 1.00 0.00 H new ATOM 0 HB3 HIS A 629 -3.767 9.534 5.296 1.00 0.00 H new ATOM 0 HD2 HIS A 629 -4.678 10.352 8.948 1.00 0.00 H new ATOM 0 HE1 HIS A 629 -7.100 12.843 6.548 1.00 0.00 H new ATOM 0 HE2 HIS A 629 -6.316 12.417 8.950 1.00 0.00 H new ATOM 38 N ILE A 630 -4.592 6.616 4.006 1.00 0.00 N ATOM 39 CA ILE A 630 -3.886 5.515 3.363 1.00 0.00 C ATOM 40 C ILE A 630 -2.961 6.033 2.267 1.00 0.00 C ATOM 41 O ILE A 630 -3.293 6.983 1.560 1.00 0.00 O ATOM 42 CB ILE A 630 -4.890 4.524 2.772 1.00 0.00 C ATOM 43 CG1 ILE A 630 -5.842 4.055 3.875 1.00 0.00 C ATOM 44 CG2 ILE A 630 -4.147 3.318 2.197 1.00 0.00 C ATOM 45 CD1 ILE A 630 -6.792 2.995 3.315 1.00 0.00 C ATOM 0 H ILE A 630 -5.198 7.153 3.385 1.00 0.00 H new ATOM 0 HA ILE A 630 -3.281 5.008 4.115 1.00 0.00 H new ATOM 0 HB ILE A 630 -5.456 5.010 1.977 1.00 0.00 H new ATOM 0 HG12 ILE A 630 -5.274 3.644 4.710 1.00 0.00 H new ATOM 0 HG13 ILE A 630 -6.411 4.900 4.262 1.00 0.00 H new ATOM 0 HG21 ILE A 630 -4.866 2.614 1.777 1.00 0.00 H new ATOM 0 HG22 ILE A 630 -3.465 3.650 1.415 1.00 0.00 H new ATOM 0 HG23 ILE A 630 -3.580 2.828 2.989 1.00 0.00 H new ATOM 0 HD11 ILE A 630 -7.469 2.662 4.101 1.00 0.00 H new ATOM 0 HD12 ILE A 630 -7.370 3.421 2.495 1.00 0.00 H new ATOM 0 HD13 ILE A 630 -6.215 2.146 2.949 1.00 0.00 H new ATOM 57 N LEU A 631 -1.798 5.404 2.134 1.00 0.00 N ATOM 58 CA LEU A 631 -0.833 5.815 1.120 1.00 0.00 C ATOM 59 C LEU A 631 -0.790 4.803 -0.018 1.00 0.00 C ATOM 60 O LEU A 631 -0.722 3.597 0.217 1.00 0.00 O ATOM 61 CB LEU A 631 0.560 5.939 1.741 1.00 0.00 C ATOM 62 CG LEU A 631 1.544 6.448 0.684 1.00 0.00 C ATOM 63 CD1 LEU A 631 1.306 7.939 0.440 1.00 0.00 C ATOM 64 CD2 LEU A 631 2.981 6.236 1.171 1.00 0.00 C ATOM 0 H LEU A 631 -1.502 4.615 2.709 1.00 0.00 H new ATOM 0 HA LEU A 631 -1.143 6.782 0.724 1.00 0.00 H new ATOM 0 HB2 LEU A 631 0.533 6.624 2.588 1.00 0.00 H new ATOM 0 HB3 LEU A 631 0.887 4.972 2.123 1.00 0.00 H new ATOM 0 HG LEU A 631 1.391 5.897 -0.244 1.00 0.00 H new ATOM 0 HD11 LEU A 631 2.007 8.301 -0.312 1.00 0.00 H new ATOM 0 HD12 LEU A 631 0.285 8.092 0.089 1.00 0.00 H new ATOM 0 HD13 LEU A 631 1.456 8.488 1.369 1.00 0.00 H new ATOM 0 HD21 LEU A 631 3.678 6.599 0.416 1.00 0.00 H new ATOM 0 HD22 LEU A 631 3.135 6.784 2.101 1.00 0.00 H new ATOM 0 HD23 LEU A 631 3.154 5.174 1.343 1.00 0.00 H new ATOM 76 N LEU A 632 -0.832 5.296 -1.254 1.00 0.00 N ATOM 77 CA LEU A 632 -0.798 4.409 -2.410 1.00 0.00 C ATOM 78 C LEU A 632 0.247 4.855 -3.427 1.00 0.00 C ATOM 79 O LEU A 632 0.170 5.957 -3.972 1.00 0.00 O ATOM 80 CB LEU A 632 -2.171 4.369 -3.082 1.00 0.00 C ATOM 81 CG LEU A 632 -2.166 3.309 -4.191 1.00 0.00 C ATOM 82 CD1 LEU A 632 -3.547 2.660 -4.286 1.00 0.00 C ATOM 83 CD2 LEU A 632 -1.821 3.959 -5.537 1.00 0.00 C ATOM 0 H LEU A 632 -0.889 6.290 -1.477 1.00 0.00 H new ATOM 0 HA LEU A 632 -0.530 3.414 -2.054 1.00 0.00 H new ATOM 0 HB2 LEU A 632 -2.941 4.138 -2.346 1.00 0.00 H new ATOM 0 HB3 LEU A 632 -2.412 5.347 -3.499 1.00 0.00 H new ATOM 0 HG LEU A 632 -1.418 2.552 -3.953 1.00 0.00 H new ATOM 0 HD11 LEU A 632 -3.542 1.907 -5.074 1.00 0.00 H new ATOM 0 HD12 LEU A 632 -3.793 2.188 -3.335 1.00 0.00 H new ATOM 0 HD13 LEU A 632 -4.292 3.422 -4.517 1.00 0.00 H new ATOM 0 HD21 LEU A 632 -1.820 3.199 -6.318 1.00 0.00 H new ATOM 0 HD22 LEU A 632 -2.563 4.722 -5.774 1.00 0.00 H new ATOM 0 HD23 LEU A 632 -0.835 4.419 -5.477 1.00 0.00 H new ATOM 95 N LEU A 633 1.207 3.975 -3.699 1.00 0.00 N ATOM 96 CA LEU A 633 2.249 4.265 -4.677 1.00 0.00 C ATOM 97 C LEU A 633 2.002 3.438 -5.931 1.00 0.00 C ATOM 98 O LEU A 633 1.981 2.208 -5.877 1.00 0.00 O ATOM 99 CB LEU A 633 3.628 3.927 -4.098 1.00 0.00 C ATOM 100 CG LEU A 633 4.718 4.240 -5.129 1.00 0.00 C ATOM 101 CD1 LEU A 633 5.025 5.739 -5.123 1.00 0.00 C ATOM 102 CD2 LEU A 633 5.988 3.460 -4.779 1.00 0.00 C ATOM 0 H LEU A 633 1.284 3.059 -3.257 1.00 0.00 H new ATOM 0 HA LEU A 633 2.224 5.326 -4.925 1.00 0.00 H new ATOM 0 HB2 LEU A 633 3.801 4.501 -3.188 1.00 0.00 H new ATOM 0 HB3 LEU A 633 3.668 2.873 -3.822 1.00 0.00 H new ATOM 0 HG LEU A 633 4.369 3.949 -6.120 1.00 0.00 H new ATOM 0 HD11 LEU A 633 5.801 5.955 -5.858 1.00 0.00 H new ATOM 0 HD12 LEU A 633 4.122 6.296 -5.374 1.00 0.00 H new ATOM 0 HD13 LEU A 633 5.371 6.036 -4.133 1.00 0.00 H new ATOM 0 HD21 LEU A 633 6.764 3.681 -5.511 1.00 0.00 H new ATOM 0 HD22 LEU A 633 6.332 3.751 -3.786 1.00 0.00 H new ATOM 0 HD23 LEU A 633 5.773 2.391 -4.790 1.00 0.00 H new ATOM 114 N GLU A 634 1.798 4.112 -7.056 1.00 0.00 N ATOM 115 CA GLU A 634 1.535 3.406 -8.304 1.00 0.00 C ATOM 116 C GLU A 634 1.822 4.291 -9.511 1.00 0.00 C ATOM 117 O GLU A 634 1.821 5.519 -9.410 1.00 0.00 O ATOM 118 CB GLU A 634 0.076 2.943 -8.331 1.00 0.00 C ATOM 119 CG GLU A 634 -0.186 2.118 -9.594 1.00 0.00 C ATOM 120 CD GLU A 634 -1.646 1.681 -9.635 1.00 0.00 C ATOM 121 OE1 GLU A 634 -2.374 2.026 -8.720 1.00 0.00 O ATOM 122 OE2 GLU A 634 -2.014 1.004 -10.581 1.00 0.00 O ATOM 0 H GLU A 634 1.809 5.129 -7.131 1.00 0.00 H new ATOM 0 HA GLU A 634 2.197 2.542 -8.357 1.00 0.00 H new ATOM 0 HB2 GLU A 634 -0.142 2.347 -7.445 1.00 0.00 H new ATOM 0 HB3 GLU A 634 -0.589 3.806 -8.306 1.00 0.00 H new ATOM 0 HG2 GLU A 634 0.051 2.708 -10.480 1.00 0.00 H new ATOM 0 HG3 GLU A 634 0.465 1.244 -9.609 1.00 0.00 H new ATOM 129 N GLU A 635 2.052 3.657 -10.655 1.00 0.00 N ATOM 130 CA GLU A 635 2.323 4.389 -11.883 1.00 0.00 C ATOM 131 C GLU A 635 1.133 4.267 -12.830 1.00 0.00 C ATOM 132 O GLU A 635 0.603 3.175 -13.026 1.00 0.00 O ATOM 133 CB GLU A 635 3.579 3.829 -12.554 1.00 0.00 C ATOM 134 CG GLU A 635 3.942 4.688 -13.766 1.00 0.00 C ATOM 135 CD GLU A 635 5.123 4.069 -14.507 1.00 0.00 C ATOM 136 OE1 GLU A 635 5.589 3.028 -14.075 1.00 0.00 O ATOM 137 OE2 GLU A 635 5.544 4.645 -15.496 1.00 0.00 O ATOM 0 H GLU A 635 2.056 2.642 -10.756 1.00 0.00 H new ATOM 0 HA GLU A 635 2.484 5.440 -11.645 1.00 0.00 H new ATOM 0 HB2 GLU A 635 4.407 3.815 -11.845 1.00 0.00 H new ATOM 0 HB3 GLU A 635 3.408 2.798 -12.865 1.00 0.00 H new ATOM 0 HG2 GLU A 635 3.085 4.770 -14.434 1.00 0.00 H new ATOM 0 HG3 GLU A 635 4.193 5.699 -13.444 1.00 0.00 H new ATOM 144 N GLU A 636 0.721 5.401 -13.398 1.00 0.00 N ATOM 145 CA GLU A 636 -0.418 5.451 -14.319 1.00 0.00 C ATOM 146 C GLU A 636 -1.621 6.071 -13.615 1.00 0.00 C ATOM 147 O GLU A 636 -2.164 5.497 -12.671 1.00 0.00 O ATOM 148 CB GLU A 636 -0.787 4.051 -14.826 1.00 0.00 C ATOM 149 CG GLU A 636 -1.746 4.178 -16.012 1.00 0.00 C ATOM 150 CD GLU A 636 -2.178 2.794 -16.483 1.00 0.00 C ATOM 151 OE1 GLU A 636 -1.728 1.822 -15.898 1.00 0.00 O ATOM 152 OE2 GLU A 636 -2.952 2.725 -17.424 1.00 0.00 O ATOM 0 H GLU A 636 1.163 6.306 -13.235 1.00 0.00 H new ATOM 0 HA GLU A 636 -0.134 6.061 -15.176 1.00 0.00 H new ATOM 0 HB2 GLU A 636 0.112 3.512 -15.126 1.00 0.00 H new ATOM 0 HB3 GLU A 636 -1.253 3.474 -14.027 1.00 0.00 H new ATOM 0 HG2 GLU A 636 -2.620 4.762 -15.723 1.00 0.00 H new ATOM 0 HG3 GLU A 636 -1.260 4.714 -16.828 1.00 0.00 H new ATOM 159 N ASP A 637 -2.026 7.250 -14.073 1.00 0.00 N ATOM 160 CA ASP A 637 -3.158 7.945 -13.471 1.00 0.00 C ATOM 161 C ASP A 637 -4.444 7.132 -13.602 1.00 0.00 C ATOM 162 O ASP A 637 -5.305 7.177 -12.724 1.00 0.00 O ATOM 163 CB ASP A 637 -3.337 9.319 -14.123 1.00 0.00 C ATOM 164 CG ASP A 637 -3.599 9.164 -15.615 1.00 0.00 C ATOM 165 OD1 ASP A 637 -3.811 8.044 -16.044 1.00 0.00 O ATOM 166 OD2 ASP A 637 -3.584 10.169 -16.309 1.00 0.00 O ATOM 0 H ASP A 637 -1.591 7.742 -14.854 1.00 0.00 H new ATOM 0 HA ASP A 637 -2.948 8.073 -12.409 1.00 0.00 H new ATOM 0 HB2 ASP A 637 -4.167 9.847 -13.654 1.00 0.00 H new ATOM 0 HB3 ASP A 637 -2.444 9.924 -13.964 1.00 0.00 H new ATOM 171 N GLU A 638 -4.575 6.392 -14.698 1.00 0.00 N ATOM 172 CA GLU A 638 -5.772 5.584 -14.911 1.00 0.00 C ATOM 173 C GLU A 638 -5.866 4.471 -13.872 1.00 0.00 C ATOM 174 O GLU A 638 -6.944 4.186 -13.346 1.00 0.00 O ATOM 175 CB GLU A 638 -5.741 4.963 -16.310 1.00 0.00 C ATOM 176 CG GLU A 638 -5.853 6.062 -17.369 1.00 0.00 C ATOM 177 CD GLU A 638 -5.894 5.439 -18.760 1.00 0.00 C ATOM 178 OE1 GLU A 638 -5.664 4.245 -18.859 1.00 0.00 O ATOM 179 OE2 GLU A 638 -6.152 6.166 -19.705 1.00 0.00 O ATOM 0 H GLU A 638 -3.880 6.334 -15.442 1.00 0.00 H new ATOM 0 HA GLU A 638 -6.642 6.234 -14.814 1.00 0.00 H new ATOM 0 HB2 GLU A 638 -4.815 4.404 -16.449 1.00 0.00 H new ATOM 0 HB3 GLU A 638 -6.561 4.254 -16.421 1.00 0.00 H new ATOM 0 HG2 GLU A 638 -6.753 6.653 -17.199 1.00 0.00 H new ATOM 0 HG3 GLU A 638 -5.005 6.743 -17.291 1.00 0.00 H new ATOM 186 N ALA A 639 -4.732 3.845 -13.580 1.00 0.00 N ATOM 187 CA ALA A 639 -4.696 2.761 -12.607 1.00 0.00 C ATOM 188 C ALA A 639 -4.771 3.298 -11.181 1.00 0.00 C ATOM 189 O ALA A 639 -5.527 2.787 -10.352 1.00 0.00 O ATOM 190 CB ALA A 639 -3.409 1.957 -12.782 1.00 0.00 C ATOM 0 H ALA A 639 -3.830 4.068 -14.001 1.00 0.00 H new ATOM 0 HA ALA A 639 -5.561 2.120 -12.778 1.00 0.00 H new ATOM 0 HB1 ALA A 639 -3.384 1.147 -12.053 1.00 0.00 H new ATOM 0 HB2 ALA A 639 -3.374 1.541 -13.789 1.00 0.00 H new ATOM 0 HB3 ALA A 639 -2.549 2.609 -12.629 1.00 0.00 H new ATOM 196 N ALA A 640 -3.981 4.329 -10.901 1.00 0.00 N ATOM 197 CA ALA A 640 -3.966 4.922 -9.570 1.00 0.00 C ATOM 198 C ALA A 640 -5.333 5.500 -9.227 1.00 0.00 C ATOM 199 O ALA A 640 -5.812 5.362 -8.102 1.00 0.00 O ATOM 200 CB ALA A 640 -2.910 6.028 -9.504 1.00 0.00 C ATOM 0 H ALA A 640 -3.349 4.767 -11.571 1.00 0.00 H new ATOM 0 HA ALA A 640 -3.722 4.143 -8.847 1.00 0.00 H new ATOM 0 HB1 ALA A 640 -2.904 6.467 -8.506 1.00 0.00 H new ATOM 0 HB2 ALA A 640 -1.928 5.607 -9.721 1.00 0.00 H new ATOM 0 HB3 ALA A 640 -3.144 6.799 -10.238 1.00 0.00 H new ATOM 206 N THR A 641 -5.957 6.149 -10.203 1.00 0.00 N ATOM 207 CA THR A 641 -7.269 6.744 -9.987 1.00 0.00 C ATOM 208 C THR A 641 -8.318 5.678 -9.682 1.00 0.00 C ATOM 209 O THR A 641 -9.149 5.854 -8.792 1.00 0.00 O ATOM 210 CB THR A 641 -7.697 7.535 -11.224 1.00 0.00 C ATOM 211 OG1 THR A 641 -6.720 8.525 -11.510 1.00 0.00 O ATOM 212 CG2 THR A 641 -9.047 8.201 -10.958 1.00 0.00 C ATOM 0 H THR A 641 -5.580 6.276 -11.142 1.00 0.00 H new ATOM 0 HA THR A 641 -7.194 7.412 -9.129 1.00 0.00 H new ATOM 0 HB THR A 641 -7.790 6.863 -12.077 1.00 0.00 H new ATOM 0 HG1 THR A 641 -6.153 8.221 -12.249 1.00 0.00 H new ATOM 0 HG21 THR A 641 -9.354 8.765 -11.838 1.00 0.00 H new ATOM 0 HG22 THR A 641 -9.793 7.437 -10.739 1.00 0.00 H new ATOM 0 HG23 THR A 641 -8.958 8.876 -10.107 1.00 0.00 H new ATOM 220 N VAL A 642 -8.284 4.579 -10.429 1.00 0.00 N ATOM 221 CA VAL A 642 -9.251 3.506 -10.225 1.00 0.00 C ATOM 222 C VAL A 642 -9.254 3.036 -8.773 1.00 0.00 C ATOM 223 O VAL A 642 -10.304 2.984 -8.129 1.00 0.00 O ATOM 224 CB VAL A 642 -8.922 2.329 -11.144 1.00 0.00 C ATOM 225 CG1 VAL A 642 -9.719 1.101 -10.705 1.00 0.00 C ATOM 226 CG2 VAL A 642 -9.298 2.689 -12.584 1.00 0.00 C ATOM 0 H VAL A 642 -7.606 4.409 -11.172 1.00 0.00 H new ATOM 0 HA VAL A 642 -10.242 3.893 -10.463 1.00 0.00 H new ATOM 0 HB VAL A 642 -7.856 2.110 -11.087 1.00 0.00 H new ATOM 0 HG11 VAL A 642 -9.485 0.262 -11.360 1.00 0.00 H new ATOM 0 HG12 VAL A 642 -9.456 0.845 -9.679 1.00 0.00 H new ATOM 0 HG13 VAL A 642 -10.785 1.320 -10.763 1.00 0.00 H new ATOM 0 HG21 VAL A 642 -9.064 1.851 -13.241 1.00 0.00 H new ATOM 0 HG22 VAL A 642 -10.365 2.906 -12.638 1.00 0.00 H new ATOM 0 HG23 VAL A 642 -8.733 3.566 -12.899 1.00 0.00 H new ATOM 236 N VAL A 643 -8.077 2.696 -8.260 1.00 0.00 N ATOM 237 CA VAL A 643 -7.967 2.235 -6.880 1.00 0.00 C ATOM 238 C VAL A 643 -8.501 3.292 -5.919 1.00 0.00 C ATOM 239 O VAL A 643 -9.196 2.974 -4.954 1.00 0.00 O ATOM 240 CB VAL A 643 -6.507 1.925 -6.546 1.00 0.00 C ATOM 241 CG1 VAL A 643 -6.388 1.560 -5.065 1.00 0.00 C ATOM 242 CG2 VAL A 643 -6.033 0.749 -7.401 1.00 0.00 C ATOM 0 H VAL A 643 -7.195 2.730 -8.771 1.00 0.00 H new ATOM 0 HA VAL A 643 -8.562 1.328 -6.771 1.00 0.00 H new ATOM 0 HB VAL A 643 -5.891 2.800 -6.753 1.00 0.00 H new ATOM 0 HG11 VAL A 643 -5.347 1.339 -4.827 1.00 0.00 H new ATOM 0 HG12 VAL A 643 -6.730 2.397 -4.456 1.00 0.00 H new ATOM 0 HG13 VAL A 643 -7.002 0.684 -4.856 1.00 0.00 H new ATOM 0 HG21 VAL A 643 -4.993 0.525 -7.166 1.00 0.00 H new ATOM 0 HG22 VAL A 643 -6.649 -0.125 -7.191 1.00 0.00 H new ATOM 0 HG23 VAL A 643 -6.119 1.008 -8.456 1.00 0.00 H new ATOM 252 N CYS A 644 -8.168 4.549 -6.189 1.00 0.00 N ATOM 253 CA CYS A 644 -8.612 5.650 -5.340 1.00 0.00 C ATOM 254 C CYS A 644 -10.134 5.722 -5.286 1.00 0.00 C ATOM 255 O CYS A 644 -10.712 5.990 -4.233 1.00 0.00 O ATOM 256 CB CYS A 644 -8.052 6.973 -5.865 1.00 0.00 C ATOM 257 SG CYS A 644 -6.244 6.927 -5.807 1.00 0.00 S ATOM 0 H CYS A 644 -7.595 4.831 -6.984 1.00 0.00 H new ATOM 0 HA CYS A 644 -8.240 5.471 -4.331 1.00 0.00 H new ATOM 0 HB2 CYS A 644 -8.390 7.143 -6.887 1.00 0.00 H new ATOM 0 HB3 CYS A 644 -8.425 7.802 -5.264 1.00 0.00 H new ATOM 0 HG CYS A 644 -5.783 6.515 -6.951 1.00 0.00 H new ATOM 263 N GLU A 645 -10.782 5.479 -6.420 1.00 0.00 N ATOM 264 CA GLU A 645 -12.238 5.519 -6.465 1.00 0.00 C ATOM 265 C GLU A 645 -12.819 4.449 -5.552 1.00 0.00 C ATOM 266 O GLU A 645 -13.844 4.661 -4.903 1.00 0.00 O ATOM 267 CB GLU A 645 -12.732 5.290 -7.895 1.00 0.00 C ATOM 268 CG GLU A 645 -12.362 6.491 -8.766 1.00 0.00 C ATOM 269 CD GLU A 645 -13.061 7.744 -8.250 1.00 0.00 C ATOM 270 OE1 GLU A 645 -13.993 7.602 -7.475 1.00 0.00 O ATOM 271 OE2 GLU A 645 -12.658 8.828 -8.641 1.00 0.00 O ATOM 0 H GLU A 645 -10.331 5.256 -7.307 1.00 0.00 H new ATOM 0 HA GLU A 645 -12.567 6.501 -6.126 1.00 0.00 H new ATOM 0 HB2 GLU A 645 -12.287 4.382 -8.303 1.00 0.00 H new ATOM 0 HB3 GLU A 645 -13.812 5.145 -7.898 1.00 0.00 H new ATOM 0 HG2 GLU A 645 -11.282 6.638 -8.758 1.00 0.00 H new ATOM 0 HG3 GLU A 645 -12.650 6.303 -9.800 1.00 0.00 H new ATOM 278 N MET A 646 -12.156 3.298 -5.505 1.00 0.00 N ATOM 279 CA MET A 646 -12.617 2.201 -4.665 1.00 0.00 C ATOM 280 C MET A 646 -12.450 2.559 -3.189 1.00 0.00 C ATOM 281 O MET A 646 -13.379 2.413 -2.392 1.00 0.00 O ATOM 282 CB MET A 646 -11.807 0.942 -4.982 1.00 0.00 C ATOM 283 CG MET A 646 -11.839 0.690 -6.492 1.00 0.00 C ATOM 284 SD MET A 646 -13.480 0.109 -6.981 1.00 0.00 S ATOM 285 CE MET A 646 -13.224 -1.637 -6.578 1.00 0.00 C ATOM 0 H MET A 646 -11.306 3.102 -6.034 1.00 0.00 H new ATOM 0 HA MET A 646 -13.673 2.019 -4.866 1.00 0.00 H new ATOM 0 HB2 MET A 646 -10.778 1.062 -4.643 1.00 0.00 H new ATOM 0 HB3 MET A 646 -12.220 0.085 -4.449 1.00 0.00 H new ATOM 0 HG2 MET A 646 -11.593 1.606 -7.028 1.00 0.00 H new ATOM 0 HG3 MET A 646 -11.086 -0.050 -6.763 1.00 0.00 H new ATOM 0 HE1 MET A 646 -14.179 -2.095 -6.321 1.00 0.00 H new ATOM 0 HE2 MET A 646 -12.795 -2.150 -7.439 1.00 0.00 H new ATOM 0 HE3 MET A 646 -12.543 -1.719 -5.731 1.00 0.00 H new ATOM 295 N LEU A 647 -11.261 3.041 -2.836 1.00 0.00 N ATOM 296 CA LEU A 647 -10.985 3.428 -1.458 1.00 0.00 C ATOM 297 C LEU A 647 -11.780 4.671 -1.084 1.00 0.00 C ATOM 298 O LEU A 647 -12.359 4.745 0.001 1.00 0.00 O ATOM 299 CB LEU A 647 -9.489 3.694 -1.273 1.00 0.00 C ATOM 300 CG LEU A 647 -8.750 2.367 -1.084 1.00 0.00 C ATOM 301 CD1 LEU A 647 -8.725 1.593 -2.403 1.00 0.00 C ATOM 302 CD2 LEU A 647 -7.314 2.647 -0.635 1.00 0.00 C ATOM 0 H LEU A 647 -10.481 3.172 -3.480 1.00 0.00 H new ATOM 0 HA LEU A 647 -11.285 2.609 -0.804 1.00 0.00 H new ATOM 0 HB2 LEU A 647 -9.093 4.222 -2.141 1.00 0.00 H new ATOM 0 HB3 LEU A 647 -9.328 4.338 -0.408 1.00 0.00 H new ATOM 0 HG LEU A 647 -9.265 1.774 -0.328 1.00 0.00 H new ATOM 0 HD11 LEU A 647 -8.198 0.650 -2.261 1.00 0.00 H new ATOM 0 HD12 LEU A 647 -9.746 1.393 -2.727 1.00 0.00 H new ATOM 0 HD13 LEU A 647 -8.213 2.184 -3.162 1.00 0.00 H new ATOM 0 HD21 LEU A 647 -6.785 1.704 -0.499 1.00 0.00 H new ATOM 0 HD22 LEU A 647 -6.805 3.243 -1.393 1.00 0.00 H new ATOM 0 HD23 LEU A 647 -7.328 3.194 0.308 1.00 0.00 H new ATOM 314 N THR A 648 -11.816 5.644 -1.991 1.00 0.00 N ATOM 315 CA THR A 648 -12.559 6.870 -1.737 1.00 0.00 C ATOM 316 C THR A 648 -14.006 6.533 -1.403 1.00 0.00 C ATOM 317 O THR A 648 -14.600 7.118 -0.497 1.00 0.00 O ATOM 318 CB THR A 648 -12.515 7.783 -2.966 1.00 0.00 C ATOM 319 OG1 THR A 648 -11.163 7.983 -3.356 1.00 0.00 O ATOM 320 CG2 THR A 648 -13.154 9.130 -2.623 1.00 0.00 C ATOM 0 H THR A 648 -11.346 5.607 -2.895 1.00 0.00 H new ATOM 0 HA THR A 648 -12.102 7.390 -0.895 1.00 0.00 H new ATOM 0 HB THR A 648 -13.065 7.320 -3.785 1.00 0.00 H new ATOM 0 HG1 THR A 648 -10.783 7.135 -3.666 1.00 0.00 H new ATOM 0 HG21 THR A 648 -13.123 9.780 -3.497 1.00 0.00 H new ATOM 0 HG22 THR A 648 -14.190 8.975 -2.322 1.00 0.00 H new ATOM 0 HG23 THR A 648 -12.605 9.596 -1.805 1.00 0.00 H new ATOM 328 N ALA A 649 -14.561 5.576 -2.141 1.00 0.00 N ATOM 329 CA ALA A 649 -15.936 5.151 -1.917 1.00 0.00 C ATOM 330 C ALA A 649 -16.062 4.455 -0.566 1.00 0.00 C ATOM 331 O ALA A 649 -17.118 4.492 0.067 1.00 0.00 O ATOM 332 CB ALA A 649 -16.378 4.198 -3.029 1.00 0.00 C ATOM 0 H ALA A 649 -14.082 5.083 -2.895 1.00 0.00 H new ATOM 0 HA ALA A 649 -16.577 6.033 -1.923 1.00 0.00 H new ATOM 0 HB1 ALA A 649 -17.407 3.886 -2.853 1.00 0.00 H new ATOM 0 HB2 ALA A 649 -16.313 4.706 -3.991 1.00 0.00 H new ATOM 0 HB3 ALA A 649 -15.729 3.322 -3.037 1.00 0.00 H new ATOM 338 N ALA A 650 -14.979 3.815 -0.132 1.00 0.00 N ATOM 339 CA ALA A 650 -14.986 3.107 1.145 1.00 0.00 C ATOM 340 C ALA A 650 -15.011 4.094 2.309 1.00 0.00 C ATOM 341 O ALA A 650 -15.128 3.699 3.469 1.00 0.00 O ATOM 342 CB ALA A 650 -13.746 2.216 1.252 1.00 0.00 C ATOM 0 H ALA A 650 -14.095 3.772 -0.639 1.00 0.00 H new ATOM 0 HA ALA A 650 -15.883 2.490 1.192 1.00 0.00 H new ATOM 0 HB1 ALA A 650 -13.757 1.690 2.207 1.00 0.00 H new ATOM 0 HB2 ALA A 650 -13.748 1.491 0.438 1.00 0.00 H new ATOM 0 HB3 ALA A 650 -12.849 2.832 1.187 1.00 0.00 H new ATOM 348 N GLY A 651 -14.913 5.381 1.989 1.00 0.00 N ATOM 349 CA GLY A 651 -14.937 6.421 3.013 1.00 0.00 C ATOM 350 C GLY A 651 -13.525 6.822 3.429 1.00 0.00 C ATOM 351 O GLY A 651 -13.338 7.788 4.170 1.00 0.00 O ATOM 0 H GLY A 651 -14.817 5.728 1.035 1.00 0.00 H new ATOM 0 HA2 GLY A 651 -15.469 7.294 2.635 1.00 0.00 H new ATOM 0 HA3 GLY A 651 -15.488 6.065 3.884 1.00 0.00 H new ATOM 355 N PHE A 652 -12.535 6.078 2.950 1.00 0.00 N ATOM 356 CA PHE A 652 -11.145 6.368 3.282 1.00 0.00 C ATOM 357 C PHE A 652 -10.480 7.181 2.178 1.00 0.00 C ATOM 358 O PHE A 652 -10.671 6.910 0.993 1.00 0.00 O ATOM 359 CB PHE A 652 -10.371 5.066 3.491 1.00 0.00 C ATOM 360 CG PHE A 652 -10.898 4.354 4.713 1.00 0.00 C ATOM 361 CD1 PHE A 652 -10.453 4.733 5.985 1.00 0.00 C ATOM 362 CD2 PHE A 652 -11.828 3.317 4.576 1.00 0.00 C ATOM 363 CE1 PHE A 652 -10.938 4.076 7.121 1.00 0.00 C ATOM 364 CE2 PHE A 652 -12.313 2.659 5.713 1.00 0.00 C ATOM 365 CZ PHE A 652 -11.868 3.038 6.985 1.00 0.00 C ATOM 0 H PHE A 652 -12.667 5.275 2.335 1.00 0.00 H new ATOM 0 HA PHE A 652 -11.133 6.951 4.203 1.00 0.00 H new ATOM 0 HB2 PHE A 652 -10.471 4.427 2.614 1.00 0.00 H new ATOM 0 HB3 PHE A 652 -9.309 5.278 3.611 1.00 0.00 H new ATOM 0 HD1 PHE A 652 -9.735 5.533 6.089 1.00 0.00 H new ATOM 0 HD2 PHE A 652 -12.171 3.025 3.595 1.00 0.00 H new ATOM 0 HE1 PHE A 652 -10.595 4.369 8.102 1.00 0.00 H new ATOM 0 HE2 PHE A 652 -13.031 1.859 5.609 1.00 0.00 H new ATOM 0 HZ PHE A 652 -12.242 2.530 7.862 1.00 0.00 H new ATOM 375 N LYS A 653 -9.690 8.171 2.576 1.00 0.00 N ATOM 376 CA LYS A 653 -8.990 9.011 1.612 1.00 0.00 C ATOM 377 C LYS A 653 -7.605 8.439 1.333 1.00 0.00 C ATOM 378 O LYS A 653 -6.879 8.072 2.256 1.00 0.00 O ATOM 379 CB LYS A 653 -8.853 10.434 2.157 1.00 0.00 C ATOM 380 CG LYS A 653 -8.420 11.372 1.029 1.00 0.00 C ATOM 381 CD LYS A 653 -7.765 12.620 1.623 1.00 0.00 C ATOM 382 CE LYS A 653 -8.817 13.460 2.349 1.00 0.00 C ATOM 383 NZ LYS A 653 -9.777 14.018 1.356 1.00 0.00 N ATOM 0 H LYS A 653 -9.519 8.411 3.553 1.00 0.00 H new ATOM 0 HA LYS A 653 -9.565 9.035 0.686 1.00 0.00 H new ATOM 0 HB2 LYS A 653 -9.802 10.767 2.577 1.00 0.00 H new ATOM 0 HB3 LYS A 653 -8.121 10.457 2.965 1.00 0.00 H new ATOM 0 HG2 LYS A 653 -7.720 10.862 0.367 1.00 0.00 H new ATOM 0 HG3 LYS A 653 -9.283 11.654 0.425 1.00 0.00 H new ATOM 0 HD2 LYS A 653 -6.974 12.332 2.316 1.00 0.00 H new ATOM 0 HD3 LYS A 653 -7.298 13.208 0.833 1.00 0.00 H new ATOM 0 HE2 LYS A 653 -9.347 12.848 3.079 1.00 0.00 H new ATOM 0 HE3 LYS A 653 -8.336 14.268 2.900 1.00 0.00 H new ATOM 0 HZ1 LYS A 653 -10.233 14.865 1.752 1.00 0.00 H new ATOM 0 HZ2 LYS A 653 -9.267 14.274 0.486 1.00 0.00 H new ATOM 0 HZ3 LYS A 653 -10.502 13.306 1.136 1.00 0.00 H new ATOM 397 N VAL A 654 -7.249 8.353 0.058 1.00 0.00 N ATOM 398 CA VAL A 654 -5.951 7.809 -0.323 1.00 0.00 C ATOM 399 C VAL A 654 -5.183 8.784 -1.207 1.00 0.00 C ATOM 400 O VAL A 654 -5.761 9.450 -2.067 1.00 0.00 O ATOM 401 CB VAL A 654 -6.145 6.486 -1.062 1.00 0.00 C ATOM 402 CG1 VAL A 654 -7.017 6.712 -2.299 1.00 0.00 C ATOM 403 CG2 VAL A 654 -4.782 5.940 -1.495 1.00 0.00 C ATOM 0 H VAL A 654 -7.834 8.650 -0.723 1.00 0.00 H new ATOM 0 HA VAL A 654 -5.371 7.643 0.585 1.00 0.00 H new ATOM 0 HB VAL A 654 -6.633 5.770 -0.400 1.00 0.00 H new ATOM 0 HG11 VAL A 654 -7.154 5.767 -2.825 1.00 0.00 H new ATOM 0 HG12 VAL A 654 -7.988 7.102 -1.993 1.00 0.00 H new ATOM 0 HG13 VAL A 654 -6.531 7.428 -2.961 1.00 0.00 H new ATOM 0 HG21 VAL A 654 -4.919 4.996 -2.022 1.00 0.00 H new ATOM 0 HG22 VAL A 654 -4.296 6.658 -2.156 1.00 0.00 H new ATOM 0 HG23 VAL A 654 -4.159 5.777 -0.615 1.00 0.00 H new ATOM 413 N ILE A 655 -3.874 8.857 -0.988 1.00 0.00 N ATOM 414 CA ILE A 655 -3.024 9.747 -1.768 1.00 0.00 C ATOM 415 C ILE A 655 -2.172 8.935 -2.736 1.00 0.00 C ATOM 416 O ILE A 655 -1.525 7.964 -2.343 1.00 0.00 O ATOM 417 CB ILE A 655 -2.116 10.550 -0.837 1.00 0.00 C ATOM 418 CG1 ILE A 655 -2.970 11.263 0.216 1.00 0.00 C ATOM 419 CG2 ILE A 655 -1.341 11.589 -1.650 1.00 0.00 C ATOM 420 CD1 ILE A 655 -2.059 11.935 1.246 1.00 0.00 C ATOM 0 H ILE A 655 -3.381 8.313 -0.280 1.00 0.00 H new ATOM 0 HA ILE A 655 -3.656 10.433 -2.333 1.00 0.00 H new ATOM 0 HB ILE A 655 -1.415 9.877 -0.344 1.00 0.00 H new ATOM 0 HG12 ILE A 655 -3.607 12.007 -0.261 1.00 0.00 H new ATOM 0 HG13 ILE A 655 -3.629 10.548 0.709 1.00 0.00 H new ATOM 0 HG21 ILE A 655 -0.694 12.162 -0.986 1.00 0.00 H new ATOM 0 HG22 ILE A 655 -0.734 11.084 -2.402 1.00 0.00 H new ATOM 0 HG23 ILE A 655 -2.042 12.263 -2.142 1.00 0.00 H new ATOM 0 HD11 ILE A 655 -2.668 12.442 1.995 1.00 0.00 H new ATOM 0 HD12 ILE A 655 -1.440 11.180 1.732 1.00 0.00 H new ATOM 0 HD13 ILE A 655 -1.419 12.662 0.746 1.00 0.00 H new ATOM 432 N TRP A 656 -2.181 9.333 -4.001 1.00 0.00 N ATOM 433 CA TRP A 656 -1.410 8.628 -5.017 1.00 0.00 C ATOM 434 C TRP A 656 -0.041 9.273 -5.203 1.00 0.00 C ATOM 435 O TRP A 656 0.061 10.442 -5.575 1.00 0.00 O ATOM 436 CB TRP A 656 -2.173 8.646 -6.342 1.00 0.00 C ATOM 437 CG TRP A 656 -1.311 8.085 -7.425 1.00 0.00 C ATOM 438 CD1 TRP A 656 -0.453 7.050 -7.279 1.00 0.00 C ATOM 439 CD2 TRP A 656 -1.209 8.510 -8.815 1.00 0.00 C ATOM 440 NE1 TRP A 656 0.171 6.813 -8.492 1.00 0.00 N ATOM 441 CE2 TRP A 656 -0.262 7.688 -9.469 1.00 0.00 C ATOM 442 CE3 TRP A 656 -1.840 9.520 -9.562 1.00 0.00 C ATOM 443 CZ2 TRP A 656 0.048 7.862 -10.819 1.00 0.00 C ATOM 444 CZ3 TRP A 656 -1.531 9.698 -10.920 1.00 0.00 C ATOM 445 CH2 TRP A 656 -0.589 8.871 -11.547 1.00 0.00 C ATOM 0 H TRP A 656 -2.709 10.134 -4.347 1.00 0.00 H new ATOM 0 HA TRP A 656 -1.264 7.598 -4.690 1.00 0.00 H new ATOM 0 HB2 TRP A 656 -3.089 8.062 -6.253 1.00 0.00 H new ATOM 0 HB3 TRP A 656 -2.468 9.666 -6.590 1.00 0.00 H new ATOM 0 HD1 TRP A 656 -0.283 6.499 -6.366 1.00 0.00 H new ATOM 0 HE1 TRP A 656 0.865 6.082 -8.645 1.00 0.00 H new ATOM 0 HE3 TRP A 656 -2.567 10.163 -9.088 1.00 0.00 H new ATOM 0 HZ2 TRP A 656 0.775 7.222 -11.297 1.00 0.00 H new ATOM 0 HZ3 TRP A 656 -2.022 10.477 -11.485 1.00 0.00 H new ATOM 0 HH2 TRP A 656 -0.355 9.013 -12.592 1.00 0.00 H new ATOM 456 N LEU A 657 1.009 8.500 -4.943 1.00 0.00 N ATOM 457 CA LEU A 657 2.370 9.001 -5.087 1.00 0.00 C ATOM 458 C LEU A 657 3.055 8.360 -6.289 1.00 0.00 C ATOM 459 O LEU A 657 2.848 7.179 -6.581 1.00 0.00 O ATOM 460 CB LEU A 657 3.179 8.706 -3.821 1.00 0.00 C ATOM 461 CG LEU A 657 2.866 9.753 -2.747 1.00 0.00 C ATOM 462 CD1 LEU A 657 3.597 11.057 -3.077 1.00 0.00 C ATOM 463 CD2 LEU A 657 1.358 10.013 -2.702 1.00 0.00 C ATOM 0 H LEU A 657 0.944 7.530 -4.633 1.00 0.00 H new ATOM 0 HA LEU A 657 2.321 10.079 -5.242 1.00 0.00 H new ATOM 0 HB2 LEU A 657 2.940 7.709 -3.450 1.00 0.00 H new ATOM 0 HB3 LEU A 657 4.245 8.714 -4.050 1.00 0.00 H new ATOM 0 HG LEU A 657 3.198 9.383 -1.777 1.00 0.00 H new ATOM 0 HD11 LEU A 657 3.375 11.802 -2.313 1.00 0.00 H new ATOM 0 HD12 LEU A 657 4.671 10.875 -3.104 1.00 0.00 H new ATOM 0 HD13 LEU A 657 3.266 11.424 -4.049 1.00 0.00 H new ATOM 0 HD21 LEU A 657 1.140 10.758 -1.937 1.00 0.00 H new ATOM 0 HD22 LEU A 657 1.023 10.380 -3.672 1.00 0.00 H new ATOM 0 HD23 LEU A 657 0.836 9.086 -2.465 1.00 0.00 H new ATOM 475 N VAL A 658 3.871 9.150 -6.982 1.00 0.00 N ATOM 476 CA VAL A 658 4.590 8.662 -8.153 1.00 0.00 C ATOM 477 C VAL A 658 6.056 8.410 -7.815 1.00 0.00 C ATOM 478 O VAL A 658 6.854 8.070 -8.688 1.00 0.00 O ATOM 479 CB VAL A 658 4.499 9.685 -9.285 1.00 0.00 C ATOM 480 CG1 VAL A 658 5.302 9.187 -10.487 1.00 0.00 C ATOM 481 CG2 VAL A 658 3.034 9.869 -9.692 1.00 0.00 C ATOM 0 H VAL A 658 4.050 10.128 -6.753 1.00 0.00 H new ATOM 0 HA VAL A 658 4.133 7.724 -8.470 1.00 0.00 H new ATOM 0 HB VAL A 658 4.904 10.638 -8.946 1.00 0.00 H new ATOM 0 HG11 VAL A 658 5.238 9.916 -11.295 1.00 0.00 H new ATOM 0 HG12 VAL A 658 6.345 9.056 -10.199 1.00 0.00 H new ATOM 0 HG13 VAL A 658 4.897 8.234 -10.826 1.00 0.00 H new ATOM 0 HG21 VAL A 658 2.970 10.599 -10.499 1.00 0.00 H new ATOM 0 HG22 VAL A 658 2.628 8.916 -10.031 1.00 0.00 H new ATOM 0 HG23 VAL A 658 2.460 10.224 -8.836 1.00 0.00 H new ATOM 491 N ASP A 659 6.399 8.578 -6.542 1.00 0.00 N ATOM 492 CA ASP A 659 7.770 8.370 -6.086 1.00 0.00 C ATOM 493 C ASP A 659 7.770 7.801 -4.673 1.00 0.00 C ATOM 494 O ASP A 659 7.231 8.409 -3.750 1.00 0.00 O ATOM 495 CB ASP A 659 8.537 9.696 -6.096 1.00 0.00 C ATOM 496 CG ASP A 659 8.783 10.157 -7.529 1.00 0.00 C ATOM 497 OD1 ASP A 659 8.627 9.347 -8.427 1.00 0.00 O ATOM 498 OD2 ASP A 659 9.131 11.313 -7.707 1.00 0.00 O ATOM 0 H ASP A 659 5.748 8.857 -5.808 1.00 0.00 H new ATOM 0 HA ASP A 659 8.256 7.666 -6.761 1.00 0.00 H new ATOM 0 HB2 ASP A 659 7.971 10.455 -5.555 1.00 0.00 H new ATOM 0 HB3 ASP A 659 9.488 9.577 -5.577 1.00 0.00 H new ATOM 503 N GLY A 660 8.371 6.628 -4.511 1.00 0.00 N ATOM 504 CA GLY A 660 8.425 5.988 -3.204 1.00 0.00 C ATOM 505 C GLY A 660 9.083 6.896 -2.170 1.00 0.00 C ATOM 506 O GLY A 660 8.609 7.005 -1.041 1.00 0.00 O ATOM 0 H GLY A 660 8.824 6.106 -5.261 1.00 0.00 H new ATOM 0 HA2 GLY A 660 7.416 5.734 -2.879 1.00 0.00 H new ATOM 0 HA3 GLY A 660 8.981 5.053 -3.277 1.00 0.00 H new ATOM 510 N SER A 661 10.177 7.543 -2.560 1.00 0.00 N ATOM 511 CA SER A 661 10.889 8.432 -1.648 1.00 0.00 C ATOM 512 C SER A 661 9.999 9.588 -1.198 1.00 0.00 C ATOM 513 O SER A 661 10.019 9.980 -0.030 1.00 0.00 O ATOM 514 CB SER A 661 12.135 8.986 -2.336 1.00 0.00 C ATOM 515 OG SER A 661 11.745 9.747 -3.472 1.00 0.00 O ATOM 0 H SER A 661 10.587 7.470 -3.491 1.00 0.00 H new ATOM 0 HA SER A 661 11.177 7.857 -0.768 1.00 0.00 H new ATOM 0 HB2 SER A 661 12.700 9.609 -1.643 1.00 0.00 H new ATOM 0 HB3 SER A 661 12.791 8.170 -2.638 1.00 0.00 H new ATOM 0 HG SER A 661 12.542 10.106 -3.915 1.00 0.00 H new ATOM 521 N THR A 662 9.217 10.127 -2.125 1.00 0.00 N ATOM 522 CA THR A 662 8.326 11.234 -1.800 1.00 0.00 C ATOM 523 C THR A 662 7.276 10.785 -0.794 1.00 0.00 C ATOM 524 O THR A 662 6.899 11.533 0.110 1.00 0.00 O ATOM 525 CB THR A 662 7.638 11.743 -3.070 1.00 0.00 C ATOM 526 OG1 THR A 662 8.622 12.049 -4.048 1.00 0.00 O ATOM 527 CG2 THR A 662 6.829 13.000 -2.749 1.00 0.00 C ATOM 0 H THR A 662 9.181 9.820 -3.097 1.00 0.00 H new ATOM 0 HA THR A 662 8.915 12.040 -1.363 1.00 0.00 H new ATOM 0 HB THR A 662 6.969 10.973 -3.453 1.00 0.00 H new ATOM 0 HG1 THR A 662 8.202 12.520 -4.798 1.00 0.00 H new ATOM 0 HG21 THR A 662 6.341 13.360 -3.655 1.00 0.00 H new ATOM 0 HG22 THR A 662 6.074 12.765 -1.999 1.00 0.00 H new ATOM 0 HG23 THR A 662 7.495 13.773 -2.364 1.00 0.00 H new ATOM 535 N ALA A 663 6.804 9.557 -0.964 1.00 0.00 N ATOM 536 CA ALA A 663 5.789 9.007 -0.076 1.00 0.00 C ATOM 537 C ALA A 663 6.309 8.876 1.353 1.00 0.00 C ATOM 538 O ALA A 663 5.612 9.221 2.304 1.00 0.00 O ATOM 539 CB ALA A 663 5.342 7.638 -0.589 1.00 0.00 C ATOM 0 H ALA A 663 7.106 8.925 -1.706 1.00 0.00 H new ATOM 0 HA ALA A 663 4.942 9.693 -0.066 1.00 0.00 H new ATOM 0 HB1 ALA A 663 4.583 7.230 0.078 1.00 0.00 H new ATOM 0 HB2 ALA A 663 4.926 7.743 -1.591 1.00 0.00 H new ATOM 0 HB3 ALA A 663 6.198 6.964 -0.620 1.00 0.00 H new ATOM 545 N LEU A 664 7.528 8.369 1.502 1.00 0.00 N ATOM 546 CA LEU A 664 8.109 8.194 2.832 1.00 0.00 C ATOM 547 C LEU A 664 8.172 9.521 3.585 1.00 0.00 C ATOM 548 O LEU A 664 7.830 9.595 4.771 1.00 0.00 O ATOM 549 CB LEU A 664 9.522 7.615 2.720 1.00 0.00 C ATOM 550 CG LEU A 664 9.477 6.259 2.015 1.00 0.00 C ATOM 551 CD1 LEU A 664 10.856 5.601 2.093 1.00 0.00 C ATOM 552 CD2 LEU A 664 8.446 5.359 2.699 1.00 0.00 C ATOM 0 H LEU A 664 8.128 8.075 0.731 1.00 0.00 H new ATOM 0 HA LEU A 664 7.470 7.505 3.385 1.00 0.00 H new ATOM 0 HB2 LEU A 664 10.162 8.301 2.166 1.00 0.00 H new ATOM 0 HB3 LEU A 664 9.958 7.504 3.713 1.00 0.00 H new ATOM 0 HG LEU A 664 9.197 6.402 0.971 1.00 0.00 H new ATOM 0 HD11 LEU A 664 10.827 4.634 1.591 1.00 0.00 H new ATOM 0 HD12 LEU A 664 11.592 6.240 1.606 1.00 0.00 H new ATOM 0 HD13 LEU A 664 11.133 5.459 3.138 1.00 0.00 H new ATOM 0 HD21 LEU A 664 8.415 4.393 2.195 1.00 0.00 H new ATOM 0 HD22 LEU A 664 8.724 5.215 3.743 1.00 0.00 H new ATOM 0 HD23 LEU A 664 7.463 5.827 2.647 1.00 0.00 H new ATOM 564 N ASP A 665 8.614 10.568 2.892 1.00 0.00 N ATOM 565 CA ASP A 665 8.728 11.883 3.513 1.00 0.00 C ATOM 566 C ASP A 665 7.374 12.350 4.029 1.00 0.00 C ATOM 567 O ASP A 665 7.275 12.909 5.122 1.00 0.00 O ATOM 568 CB ASP A 665 9.266 12.895 2.499 1.00 0.00 C ATOM 569 CG ASP A 665 10.706 12.553 2.132 1.00 0.00 C ATOM 570 OD1 ASP A 665 11.284 11.711 2.801 1.00 0.00 O ATOM 571 OD2 ASP A 665 11.211 13.138 1.187 1.00 0.00 O ATOM 0 H ASP A 665 8.896 10.532 1.912 1.00 0.00 H new ATOM 0 HA ASP A 665 9.419 11.808 4.353 1.00 0.00 H new ATOM 0 HB2 ASP A 665 8.644 12.891 1.604 1.00 0.00 H new ATOM 0 HB3 ASP A 665 9.218 13.901 2.916 1.00 0.00 H new ATOM 576 N GLN A 666 6.331 12.108 3.246 1.00 0.00 N ATOM 577 CA GLN A 666 4.988 12.500 3.650 1.00 0.00 C ATOM 578 C GLN A 666 4.357 11.401 4.497 1.00 0.00 C ATOM 579 O GLN A 666 3.459 11.655 5.299 1.00 0.00 O ATOM 580 CB GLN A 666 4.128 12.764 2.413 1.00 0.00 C ATOM 581 CG GLN A 666 4.699 13.958 1.643 1.00 0.00 C ATOM 582 CD GLN A 666 3.901 14.185 0.364 1.00 0.00 C ATOM 583 OE1 GLN A 666 3.351 13.241 -0.203 1.00 0.00 O ATOM 584 NE2 GLN A 666 3.803 15.391 -0.127 1.00 0.00 N ATOM 0 H GLN A 666 6.387 11.647 2.338 1.00 0.00 H new ATOM 0 HA GLN A 666 5.048 13.413 4.242 1.00 0.00 H new ATOM 0 HB2 GLN A 666 4.109 11.881 1.774 1.00 0.00 H new ATOM 0 HB3 GLN A 666 3.098 12.966 2.708 1.00 0.00 H new ATOM 0 HG2 GLN A 666 4.665 14.852 2.266 1.00 0.00 H new ATOM 0 HG3 GLN A 666 5.746 13.777 1.401 1.00 0.00 H new ATOM 0 HE21 GLN A 666 4.259 16.172 0.344 1.00 0.00 H new ATOM 0 HE22 GLN A 666 3.270 15.552 -0.982 1.00 0.00 H new ATOM 593 N LEU A 667 4.845 10.176 4.315 1.00 0.00 N ATOM 594 CA LEU A 667 4.334 9.039 5.068 1.00 0.00 C ATOM 595 C LEU A 667 4.315 9.356 6.555 1.00 0.00 C ATOM 596 O LEU A 667 3.336 9.087 7.250 1.00 0.00 O ATOM 597 CB LEU A 667 5.219 7.815 4.830 1.00 0.00 C ATOM 598 CG LEU A 667 4.617 6.607 5.547 1.00 0.00 C ATOM 599 CD1 LEU A 667 3.821 5.768 4.548 1.00 0.00 C ATOM 600 CD2 LEU A 667 5.740 5.760 6.152 1.00 0.00 C ATOM 0 H LEU A 667 5.589 9.948 3.656 1.00 0.00 H new ATOM 0 HA LEU A 667 3.319 8.830 4.730 1.00 0.00 H new ATOM 0 HB2 LEU A 667 5.301 7.614 3.762 1.00 0.00 H new ATOM 0 HB3 LEU A 667 6.228 8.005 5.197 1.00 0.00 H new ATOM 0 HG LEU A 667 3.954 6.948 6.342 1.00 0.00 H new ATOM 0 HD11 LEU A 667 3.391 4.906 5.058 1.00 0.00 H new ATOM 0 HD12 LEU A 667 3.021 6.373 4.121 1.00 0.00 H new ATOM 0 HD13 LEU A 667 4.482 5.426 3.752 1.00 0.00 H new ATOM 0 HD21 LEU A 667 5.311 4.898 6.663 1.00 0.00 H new ATOM 0 HD22 LEU A 667 6.405 5.417 5.359 1.00 0.00 H new ATOM 0 HD23 LEU A 667 6.305 6.361 6.865 1.00 0.00 H new ATOM 612 N ASP A 668 5.412 9.929 7.034 1.00 0.00 N ATOM 613 CA ASP A 668 5.521 10.281 8.444 1.00 0.00 C ATOM 614 C ASP A 668 4.470 11.318 8.828 1.00 0.00 C ATOM 615 O ASP A 668 4.022 11.365 9.974 1.00 0.00 O ATOM 616 CB ASP A 668 6.917 10.835 8.738 1.00 0.00 C ATOM 617 CG ASP A 668 7.956 9.728 8.599 1.00 0.00 C ATOM 618 OD1 ASP A 668 7.560 8.575 8.543 1.00 0.00 O ATOM 619 OD2 ASP A 668 9.132 10.048 8.552 1.00 0.00 O ATOM 0 H ASP A 668 6.232 10.158 6.473 1.00 0.00 H new ATOM 0 HA ASP A 668 5.354 9.380 9.034 1.00 0.00 H new ATOM 0 HB2 ASP A 668 7.147 11.649 8.051 1.00 0.00 H new ATOM 0 HB3 ASP A 668 6.948 11.250 9.745 1.00 0.00 H new ATOM 624 N LEU A 669 4.096 12.160 7.871 1.00 0.00 N ATOM 625 CA LEU A 669 3.113 13.206 8.133 1.00 0.00 C ATOM 626 C LEU A 669 1.697 12.642 8.251 1.00 0.00 C ATOM 627 O LEU A 669 0.965 12.990 9.178 1.00 0.00 O ATOM 628 CB LEU A 669 3.150 14.239 7.006 1.00 0.00 C ATOM 629 CG LEU A 669 4.570 14.790 6.860 1.00 0.00 C ATOM 630 CD1 LEU A 669 4.556 15.995 5.918 1.00 0.00 C ATOM 631 CD2 LEU A 669 5.097 15.218 8.230 1.00 0.00 C ATOM 0 H LEU A 669 4.454 12.140 6.916 1.00 0.00 H new ATOM 0 HA LEU A 669 3.372 13.671 9.084 1.00 0.00 H new ATOM 0 HB2 LEU A 669 2.828 13.782 6.070 1.00 0.00 H new ATOM 0 HB3 LEU A 669 2.455 15.051 7.220 1.00 0.00 H new ATOM 0 HG LEU A 669 5.218 14.016 6.449 1.00 0.00 H new ATOM 0 HD11 LEU A 669 5.568 16.387 5.814 1.00 0.00 H new ATOM 0 HD12 LEU A 669 4.184 15.688 4.941 1.00 0.00 H new ATOM 0 HD13 LEU A 669 3.907 16.769 6.327 1.00 0.00 H new ATOM 0 HD21 LEU A 669 6.108 15.610 8.124 1.00 0.00 H new ATOM 0 HD22 LEU A 669 4.449 15.991 8.644 1.00 0.00 H new ATOM 0 HD23 LEU A 669 5.109 14.358 8.900 1.00 0.00 H new ATOM 643 N LEU A 670 1.306 11.784 7.312 1.00 0.00 N ATOM 644 CA LEU A 670 -0.039 11.208 7.347 1.00 0.00 C ATOM 645 C LEU A 670 -0.109 10.009 8.287 1.00 0.00 C ATOM 646 O LEU A 670 -1.195 9.598 8.695 1.00 0.00 O ATOM 647 CB LEU A 670 -0.492 10.789 5.944 1.00 0.00 C ATOM 648 CG LEU A 670 0.713 10.385 5.093 1.00 0.00 C ATOM 649 CD1 LEU A 670 0.311 9.238 4.165 1.00 0.00 C ATOM 650 CD2 LEU A 670 1.164 11.580 4.250 1.00 0.00 C ATOM 0 H LEU A 670 1.886 11.476 6.532 1.00 0.00 H new ATOM 0 HA LEU A 670 -0.710 11.981 7.722 1.00 0.00 H new ATOM 0 HB2 LEU A 670 -1.191 9.956 6.014 1.00 0.00 H new ATOM 0 HB3 LEU A 670 -1.024 11.612 5.466 1.00 0.00 H new ATOM 0 HG LEU A 670 1.529 10.067 5.742 1.00 0.00 H new ATOM 0 HD11 LEU A 670 1.166 8.946 3.556 1.00 0.00 H new ATOM 0 HD12 LEU A 670 -0.018 8.386 4.761 1.00 0.00 H new ATOM 0 HD13 LEU A 670 -0.502 9.563 3.516 1.00 0.00 H new ATOM 0 HD21 LEU A 670 2.023 11.294 3.643 1.00 0.00 H new ATOM 0 HD22 LEU A 670 0.348 11.895 3.599 1.00 0.00 H new ATOM 0 HD23 LEU A 670 1.443 12.404 4.907 1.00 0.00 H new ATOM 662 N GLN A 671 1.044 9.446 8.628 1.00 0.00 N ATOM 663 CA GLN A 671 1.069 8.292 9.520 1.00 0.00 C ATOM 664 C GLN A 671 -0.059 7.329 9.157 1.00 0.00 C ATOM 665 O GLN A 671 -0.982 7.109 9.941 1.00 0.00 O ATOM 666 CB GLN A 671 0.907 8.752 10.970 1.00 0.00 C ATOM 667 CG GLN A 671 2.280 9.096 11.550 1.00 0.00 C ATOM 668 CD GLN A 671 2.902 7.864 12.196 1.00 0.00 C ATOM 669 OE1 GLN A 671 2.207 7.083 12.845 1.00 0.00 O ATOM 670 NE2 GLN A 671 4.180 7.641 12.054 1.00 0.00 N ATOM 0 H GLN A 671 1.959 9.762 8.307 1.00 0.00 H new ATOM 0 HA GLN A 671 2.025 7.780 9.411 1.00 0.00 H new ATOM 0 HB2 GLN A 671 0.252 9.622 11.016 1.00 0.00 H new ATOM 0 HB3 GLN A 671 0.436 7.967 11.562 1.00 0.00 H new ATOM 0 HG2 GLN A 671 2.933 9.471 10.761 1.00 0.00 H new ATOM 0 HG3 GLN A 671 2.182 9.892 12.288 1.00 0.00 H new ATOM 0 HE21 GLN A 671 4.754 8.290 11.516 1.00 0.00 H new ATOM 0 HE22 GLN A 671 4.605 6.818 12.481 1.00 0.00 H new ATOM 679 N PRO A 672 0.000 6.770 7.981 1.00 0.00 N ATOM 680 CA PRO A 672 -1.035 5.821 7.477 1.00 0.00 C ATOM 681 C PRO A 672 -0.974 4.461 8.164 1.00 0.00 C ATOM 682 O PRO A 672 0.073 4.053 8.666 1.00 0.00 O ATOM 683 CB PRO A 672 -0.710 5.690 5.989 1.00 0.00 C ATOM 684 CG PRO A 672 0.748 5.992 5.878 1.00 0.00 C ATOM 685 CD PRO A 672 1.072 6.982 6.997 1.00 0.00 C ATOM 0 HA PRO A 672 -2.043 6.185 7.674 1.00 0.00 H new ATOM 0 HB2 PRO A 672 -0.933 4.687 5.624 1.00 0.00 H new ATOM 0 HB3 PRO A 672 -1.302 6.385 5.394 1.00 0.00 H new ATOM 0 HG2 PRO A 672 1.341 5.083 5.980 1.00 0.00 H new ATOM 0 HG3 PRO A 672 0.983 6.418 4.903 1.00 0.00 H new ATOM 0 HD2 PRO A 672 2.054 6.789 7.429 1.00 0.00 H new ATOM 0 HD3 PRO A 672 1.081 8.009 6.631 1.00 0.00 H new ATOM 693 N ILE A 673 -2.104 3.759 8.168 1.00 0.00 N ATOM 694 CA ILE A 673 -2.173 2.438 8.780 1.00 0.00 C ATOM 695 C ILE A 673 -1.926 1.360 7.733 1.00 0.00 C ATOM 696 O ILE A 673 -1.542 0.237 8.060 1.00 0.00 O ATOM 697 CB ILE A 673 -3.550 2.222 9.407 1.00 0.00 C ATOM 698 CG1 ILE A 673 -3.776 3.256 10.513 1.00 0.00 C ATOM 699 CG2 ILE A 673 -3.623 0.814 9.998 1.00 0.00 C ATOM 700 CD1 ILE A 673 -5.228 3.183 10.987 1.00 0.00 C ATOM 0 H ILE A 673 -2.980 4.082 7.756 1.00 0.00 H new ATOM 0 HA ILE A 673 -1.407 2.375 9.553 1.00 0.00 H new ATOM 0 HB ILE A 673 -4.320 2.336 8.644 1.00 0.00 H new ATOM 0 HG12 ILE A 673 -3.100 3.067 11.347 1.00 0.00 H new ATOM 0 HG13 ILE A 673 -3.553 4.256 10.142 1.00 0.00 H new ATOM 0 HG21 ILE A 673 -4.604 0.658 10.446 1.00 0.00 H new ATOM 0 HG22 ILE A 673 -3.463 0.079 9.209 1.00 0.00 H new ATOM 0 HG23 ILE A 673 -2.853 0.700 10.761 1.00 0.00 H new ATOM 0 HD11 ILE A 673 -5.391 3.919 11.775 1.00 0.00 H new ATOM 0 HD12 ILE A 673 -5.895 3.393 10.151 1.00 0.00 H new ATOM 0 HD13 ILE A 673 -5.435 2.185 11.374 1.00 0.00 H new ATOM 712 N VAL A 674 -2.152 1.711 6.472 1.00 0.00 N ATOM 713 CA VAL A 674 -1.953 0.768 5.380 1.00 0.00 C ATOM 714 C VAL A 674 -1.280 1.456 4.197 1.00 0.00 C ATOM 715 O VAL A 674 -1.639 2.575 3.825 1.00 0.00 O ATOM 716 CB VAL A 674 -3.301 0.192 4.941 1.00 0.00 C ATOM 717 CG1 VAL A 674 -3.074 -0.931 3.928 1.00 0.00 C ATOM 718 CG2 VAL A 674 -4.039 -0.364 6.162 1.00 0.00 C ATOM 0 H VAL A 674 -2.471 2.636 6.183 1.00 0.00 H new ATOM 0 HA VAL A 674 -1.309 -0.039 5.730 1.00 0.00 H new ATOM 0 HB VAL A 674 -3.898 0.979 4.481 1.00 0.00 H new ATOM 0 HG11 VAL A 674 -4.035 -1.340 3.617 1.00 0.00 H new ATOM 0 HG12 VAL A 674 -2.549 -0.536 3.058 1.00 0.00 H new ATOM 0 HG13 VAL A 674 -2.476 -1.719 4.386 1.00 0.00 H new ATOM 0 HG21 VAL A 674 -5.000 -0.775 5.851 1.00 0.00 H new ATOM 0 HG22 VAL A 674 -3.440 -1.150 6.622 1.00 0.00 H new ATOM 0 HG23 VAL A 674 -4.203 0.436 6.883 1.00 0.00 H new ATOM 728 N ILE A 675 -0.301 0.778 3.608 1.00 0.00 N ATOM 729 CA ILE A 675 0.417 1.330 2.467 1.00 0.00 C ATOM 730 C ILE A 675 0.283 0.413 1.254 1.00 0.00 C ATOM 731 O ILE A 675 0.637 -0.765 1.313 1.00 0.00 O ATOM 732 CB ILE A 675 1.895 1.499 2.823 1.00 0.00 C ATOM 733 CG1 ILE A 675 2.021 2.394 4.059 1.00 0.00 C ATOM 734 CG2 ILE A 675 2.636 2.145 1.650 1.00 0.00 C ATOM 735 CD1 ILE A 675 3.477 2.417 4.526 1.00 0.00 C ATOM 0 H ILE A 675 0.011 -0.148 3.900 1.00 0.00 H new ATOM 0 HA ILE A 675 -0.013 2.300 2.220 1.00 0.00 H new ATOM 0 HB ILE A 675 2.331 0.522 3.032 1.00 0.00 H new ATOM 0 HG12 ILE A 675 1.687 3.405 3.825 1.00 0.00 H new ATOM 0 HG13 ILE A 675 1.378 2.023 4.857 1.00 0.00 H new ATOM 0 HG21 ILE A 675 3.689 2.264 1.906 1.00 0.00 H new ATOM 0 HG22 ILE A 675 2.547 1.510 0.769 1.00 0.00 H new ATOM 0 HG23 ILE A 675 2.201 3.122 1.438 1.00 0.00 H new ATOM 0 HD11 ILE A 675 3.567 3.054 5.406 1.00 0.00 H new ATOM 0 HD12 ILE A 675 3.795 1.405 4.777 1.00 0.00 H new ATOM 0 HD13 ILE A 675 4.109 2.808 3.729 1.00 0.00 H new ATOM 747 N LEU A 676 -0.224 0.963 0.154 1.00 0.00 N ATOM 748 CA LEU A 676 -0.393 0.185 -1.068 1.00 0.00 C ATOM 749 C LEU A 676 0.647 0.592 -2.107 1.00 0.00 C ATOM 750 O LEU A 676 0.804 1.773 -2.410 1.00 0.00 O ATOM 751 CB LEU A 676 -1.794 0.408 -1.639 1.00 0.00 C ATOM 752 CG LEU A 676 -2.839 -0.101 -0.644 1.00 0.00 C ATOM 753 CD1 LEU A 676 -3.105 0.964 0.422 1.00 0.00 C ATOM 754 CD2 LEU A 676 -4.141 -0.411 -1.385 1.00 0.00 C ATOM 0 H LEU A 676 -0.522 1.936 0.084 1.00 0.00 H new ATOM 0 HA LEU A 676 -0.261 -0.870 -0.826 1.00 0.00 H new ATOM 0 HB2 LEU A 676 -1.952 1.468 -1.838 1.00 0.00 H new ATOM 0 HB3 LEU A 676 -1.898 -0.114 -2.590 1.00 0.00 H new ATOM 0 HG LEU A 676 -2.465 -1.005 -0.164 1.00 0.00 H new ATOM 0 HD11 LEU A 676 -3.850 0.595 1.127 1.00 0.00 H new ATOM 0 HD12 LEU A 676 -2.180 1.185 0.954 1.00 0.00 H new ATOM 0 HD13 LEU A 676 -3.475 1.872 -0.055 1.00 0.00 H new ATOM 0 HD21 LEU A 676 -4.886 -0.774 -0.676 1.00 0.00 H new ATOM 0 HD22 LEU A 676 -4.510 0.494 -1.867 1.00 0.00 H new ATOM 0 HD23 LEU A 676 -3.957 -1.175 -2.140 1.00 0.00 H new ATOM 766 N MET A 677 1.355 -0.386 -2.656 1.00 0.00 N ATOM 767 CA MET A 677 2.368 -0.089 -3.661 1.00 0.00 C ATOM 768 C MET A 677 2.371 -1.136 -4.769 1.00 0.00 C ATOM 769 O MET A 677 2.222 -2.332 -4.516 1.00 0.00 O ATOM 770 CB MET A 677 3.753 -0.038 -3.010 1.00 0.00 C ATOM 771 CG MET A 677 3.690 0.794 -1.728 1.00 0.00 C ATOM 772 SD MET A 677 3.393 -0.301 -0.319 1.00 0.00 S ATOM 773 CE MET A 677 4.932 -1.244 -0.445 1.00 0.00 C ATOM 0 H MET A 677 1.250 -1.375 -2.428 1.00 0.00 H new ATOM 0 HA MET A 677 2.129 0.880 -4.099 1.00 0.00 H new ATOM 0 HB2 MET A 677 4.096 -1.047 -2.783 1.00 0.00 H new ATOM 0 HB3 MET A 677 4.475 0.396 -3.702 1.00 0.00 H new ATOM 0 HG2 MET A 677 4.623 1.340 -1.589 1.00 0.00 H new ATOM 0 HG3 MET A 677 2.895 1.536 -1.801 1.00 0.00 H new ATOM 0 HE1 MET A 677 5.177 -1.672 0.527 1.00 0.00 H new ATOM 0 HE2 MET A 677 4.809 -2.045 -1.174 1.00 0.00 H new ATOM 0 HE3 MET A 677 5.738 -0.584 -0.764 1.00 0.00 H new ATOM 783 N ALA A 678 2.566 -0.673 -5.997 1.00 0.00 N ATOM 784 CA ALA A 678 2.619 -1.566 -7.146 1.00 0.00 C ATOM 785 C ALA A 678 3.834 -2.479 -7.033 1.00 0.00 C ATOM 786 O ALA A 678 4.821 -2.125 -6.389 1.00 0.00 O ATOM 787 CB ALA A 678 2.697 -0.755 -8.441 1.00 0.00 C ATOM 0 H ALA A 678 2.690 0.314 -6.222 1.00 0.00 H new ATOM 0 HA ALA A 678 1.714 -2.173 -7.165 1.00 0.00 H new ATOM 0 HB1 ALA A 678 2.736 -1.433 -9.293 1.00 0.00 H new ATOM 0 HB2 ALA A 678 1.817 -0.118 -8.525 1.00 0.00 H new ATOM 0 HB3 ALA A 678 3.594 -0.135 -8.429 1.00 0.00 H new ATOM 793 N TRP A 679 3.763 -3.653 -7.650 1.00 0.00 N ATOM 794 CA TRP A 679 4.881 -4.588 -7.585 1.00 0.00 C ATOM 795 C TRP A 679 5.727 -4.514 -8.855 1.00 0.00 C ATOM 796 O TRP A 679 6.926 -4.788 -8.817 1.00 0.00 O ATOM 797 CB TRP A 679 4.366 -6.015 -7.400 1.00 0.00 C ATOM 798 CG TRP A 679 5.521 -6.964 -7.433 1.00 0.00 C ATOM 799 CD1 TRP A 679 5.680 -7.966 -8.327 1.00 0.00 C ATOM 800 CD2 TRP A 679 6.680 -7.015 -6.551 1.00 0.00 C ATOM 801 NE1 TRP A 679 6.862 -8.629 -8.051 1.00 0.00 N ATOM 802 CE2 TRP A 679 7.514 -8.081 -6.965 1.00 0.00 C ATOM 803 CE3 TRP A 679 7.084 -6.249 -5.442 1.00 0.00 C ATOM 804 CZ2 TRP A 679 8.707 -8.375 -6.303 1.00 0.00 C ATOM 805 CZ3 TRP A 679 8.284 -6.542 -4.774 1.00 0.00 C ATOM 806 CH2 TRP A 679 9.094 -7.603 -5.204 1.00 0.00 C ATOM 0 H TRP A 679 2.961 -3.976 -8.191 1.00 0.00 H new ATOM 0 HA TRP A 679 5.502 -4.312 -6.733 1.00 0.00 H new ATOM 0 HB2 TRP A 679 3.835 -6.103 -6.452 1.00 0.00 H new ATOM 0 HB3 TRP A 679 3.654 -6.262 -8.188 1.00 0.00 H new ATOM 0 HD1 TRP A 679 4.996 -8.209 -9.126 1.00 0.00 H new ATOM 0 HE1 TRP A 679 7.209 -9.426 -8.585 1.00 0.00 H new ATOM 0 HE3 TRP A 679 6.467 -5.430 -5.102 1.00 0.00 H new ATOM 0 HZ2 TRP A 679 9.327 -9.194 -6.638 1.00 0.00 H new ATOM 0 HZ3 TRP A 679 8.585 -5.947 -3.924 1.00 0.00 H new ATOM 0 HH2 TRP A 679 10.016 -7.823 -4.686 1.00 0.00 H new ATOM 817 N PRO A 680 5.154 -4.104 -9.959 1.00 0.00 N ATOM 818 CA PRO A 680 5.915 -3.943 -11.226 1.00 0.00 C ATOM 819 C PRO A 680 6.866 -2.756 -11.125 1.00 0.00 C ATOM 820 O PRO A 680 6.581 -1.790 -10.421 1.00 0.00 O ATOM 821 CB PRO A 680 4.849 -3.687 -12.299 1.00 0.00 C ATOM 822 CG PRO A 680 3.517 -3.854 -11.636 1.00 0.00 C ATOM 823 CD PRO A 680 3.737 -3.771 -10.127 1.00 0.00 C ATOM 0 HA PRO A 680 6.524 -4.818 -11.455 1.00 0.00 H new ATOM 0 HB2 PRO A 680 4.951 -2.684 -12.714 1.00 0.00 H new ATOM 0 HB3 PRO A 680 4.959 -4.387 -13.127 1.00 0.00 H new ATOM 0 HG2 PRO A 680 2.826 -3.078 -11.965 1.00 0.00 H new ATOM 0 HG3 PRO A 680 3.073 -4.812 -11.906 1.00 0.00 H new ATOM 0 HD2 PRO A 680 3.512 -2.775 -9.745 1.00 0.00 H new ATOM 0 HD3 PRO A 680 3.096 -4.470 -9.591 1.00 0.00 H new ATOM 831 N PRO A 681 7.977 -2.812 -11.800 1.00 0.00 N ATOM 832 CA PRO A 681 8.988 -1.714 -11.771 1.00 0.00 C ATOM 833 C PRO A 681 8.520 -0.468 -12.529 1.00 0.00 C ATOM 834 O PRO A 681 8.423 -0.485 -13.756 1.00 0.00 O ATOM 835 CB PRO A 681 10.210 -2.334 -12.452 1.00 0.00 C ATOM 836 CG PRO A 681 9.670 -3.413 -13.332 1.00 0.00 C ATOM 837 CD PRO A 681 8.395 -3.926 -12.664 1.00 0.00 C ATOM 0 HA PRO A 681 9.183 -1.368 -10.756 1.00 0.00 H new ATOM 0 HB2 PRO A 681 10.756 -1.590 -13.033 1.00 0.00 H new ATOM 0 HB3 PRO A 681 10.906 -2.738 -11.717 1.00 0.00 H new ATOM 0 HG2 PRO A 681 9.457 -3.029 -14.329 1.00 0.00 H new ATOM 0 HG3 PRO A 681 10.396 -4.217 -13.449 1.00 0.00 H new ATOM 0 HD2 PRO A 681 7.629 -4.170 -13.400 1.00 0.00 H new ATOM 0 HD3 PRO A 681 8.583 -4.831 -12.086 1.00 0.00 H new ATOM 845 N PRO A 682 8.238 0.606 -11.829 1.00 0.00 N ATOM 846 CA PRO A 682 7.785 1.879 -12.450 1.00 0.00 C ATOM 847 C PRO A 682 8.960 2.801 -12.754 1.00 0.00 C ATOM 848 O PRO A 682 8.946 3.550 -13.731 1.00 0.00 O ATOM 849 CB PRO A 682 6.908 2.473 -11.356 1.00 0.00 C ATOM 850 CG PRO A 682 7.566 2.056 -10.076 1.00 0.00 C ATOM 851 CD PRO A 682 8.311 0.742 -10.364 1.00 0.00 C ATOM 0 HA PRO A 682 7.276 1.738 -13.404 1.00 0.00 H new ATOM 0 HB2 PRO A 682 6.853 3.559 -11.438 1.00 0.00 H new ATOM 0 HB3 PRO A 682 5.887 2.096 -11.418 1.00 0.00 H new ATOM 0 HG2 PRO A 682 8.258 2.824 -9.729 1.00 0.00 H new ATOM 0 HG3 PRO A 682 6.825 1.915 -9.289 1.00 0.00 H new ATOM 0 HD2 PRO A 682 9.344 0.784 -10.018 1.00 0.00 H new ATOM 0 HD3 PRO A 682 7.840 -0.103 -9.861 1.00 0.00 H new ATOM 859 N ASP A 683 9.972 2.728 -11.900 1.00 0.00 N ATOM 860 CA ASP A 683 11.171 3.543 -12.052 1.00 0.00 C ATOM 861 C ASP A 683 12.336 2.881 -11.329 1.00 0.00 C ATOM 862 O ASP A 683 13.154 2.200 -11.947 1.00 0.00 O ATOM 863 CB ASP A 683 10.936 4.943 -11.478 1.00 0.00 C ATOM 864 CG ASP A 683 10.032 5.749 -12.406 1.00 0.00 C ATOM 865 OD1 ASP A 683 10.029 5.464 -13.592 1.00 0.00 O ATOM 866 OD2 ASP A 683 9.365 6.647 -11.919 1.00 0.00 O ATOM 0 H ASP A 683 9.986 2.109 -11.090 1.00 0.00 H new ATOM 0 HA ASP A 683 11.405 3.632 -13.113 1.00 0.00 H new ATOM 0 HB2 ASP A 683 10.481 4.867 -10.491 1.00 0.00 H new ATOM 0 HB3 ASP A 683 11.889 5.456 -11.351 1.00 0.00 H new ATOM 871 N GLN A 684 12.396 3.077 -10.015 1.00 0.00 N ATOM 872 CA GLN A 684 13.460 2.488 -9.207 1.00 0.00 C ATOM 873 C GLN A 684 13.300 2.873 -7.736 1.00 0.00 C ATOM 874 O GLN A 684 13.757 2.157 -6.845 1.00 0.00 O ATOM 875 CB GLN A 684 14.827 2.954 -9.714 1.00 0.00 C ATOM 876 CG GLN A 684 15.929 2.172 -8.999 1.00 0.00 C ATOM 877 CD GLN A 684 17.287 2.524 -9.598 1.00 0.00 C ATOM 878 OE1 GLN A 684 17.355 3.129 -10.668 1.00 0.00 O ATOM 879 NE2 GLN A 684 18.377 2.183 -8.967 1.00 0.00 N ATOM 0 H GLN A 684 11.724 3.636 -9.489 1.00 0.00 H new ATOM 0 HA GLN A 684 13.393 1.404 -9.295 1.00 0.00 H new ATOM 0 HB2 GLN A 684 14.899 2.802 -10.791 1.00 0.00 H new ATOM 0 HB3 GLN A 684 14.949 4.022 -9.534 1.00 0.00 H new ATOM 0 HG2 GLN A 684 15.920 2.405 -7.934 1.00 0.00 H new ATOM 0 HG3 GLN A 684 15.747 1.101 -9.093 1.00 0.00 H new ATOM 0 HE21 GLN A 684 18.318 1.682 -8.081 1.00 0.00 H new ATOM 0 HE22 GLN A 684 19.288 2.418 -9.360 1.00 0.00 H new ATOM 888 N SER A 685 12.653 4.008 -7.490 1.00 0.00 N ATOM 889 CA SER A 685 12.442 4.480 -6.127 1.00 0.00 C ATOM 890 C SER A 685 11.551 3.514 -5.344 1.00 0.00 C ATOM 891 O SER A 685 11.719 3.344 -4.137 1.00 0.00 O ATOM 892 CB SER A 685 11.793 5.864 -6.154 1.00 0.00 C ATOM 893 OG SER A 685 11.733 6.381 -4.831 1.00 0.00 O ATOM 0 H SER A 685 12.268 4.615 -8.213 1.00 0.00 H new ATOM 0 HA SER A 685 13.411 4.536 -5.631 1.00 0.00 H new ATOM 0 HB2 SER A 685 12.367 6.535 -6.793 1.00 0.00 H new ATOM 0 HB3 SER A 685 10.791 5.800 -6.578 1.00 0.00 H new ATOM 0 HG SER A 685 11.947 7.337 -4.843 1.00 0.00 H new ATOM 899 N CYS A 686 10.602 2.889 -6.035 1.00 0.00 N ATOM 900 CA CYS A 686 9.692 1.950 -5.384 1.00 0.00 C ATOM 901 C CYS A 686 10.465 0.792 -4.758 1.00 0.00 C ATOM 902 O CYS A 686 10.073 0.266 -3.717 1.00 0.00 O ATOM 903 CB CYS A 686 8.684 1.407 -6.402 1.00 0.00 C ATOM 904 SG CYS A 686 9.273 -0.174 -7.058 1.00 0.00 S ATOM 0 H CYS A 686 10.443 3.013 -7.035 1.00 0.00 H new ATOM 0 HA CYS A 686 9.160 2.480 -4.594 1.00 0.00 H new ATOM 0 HB2 CYS A 686 7.710 1.276 -5.930 1.00 0.00 H new ATOM 0 HB3 CYS A 686 8.551 2.122 -7.214 1.00 0.00 H new ATOM 0 HG CYS A 686 8.328 -0.735 -7.753 1.00 0.00 H new ATOM 910 N LEU A 687 11.560 0.398 -5.398 1.00 0.00 N ATOM 911 CA LEU A 687 12.372 -0.702 -4.888 1.00 0.00 C ATOM 912 C LEU A 687 13.031 -0.314 -3.567 1.00 0.00 C ATOM 913 O LEU A 687 13.115 -1.124 -2.638 1.00 0.00 O ATOM 914 CB LEU A 687 13.447 -1.070 -5.913 1.00 0.00 C ATOM 915 CG LEU A 687 12.779 -1.450 -7.237 1.00 0.00 C ATOM 916 CD1 LEU A 687 13.850 -1.835 -8.260 1.00 0.00 C ATOM 917 CD2 LEU A 687 11.843 -2.640 -7.011 1.00 0.00 C ATOM 0 H LEU A 687 11.904 0.818 -6.262 1.00 0.00 H new ATOM 0 HA LEU A 687 11.725 -1.562 -4.716 1.00 0.00 H new ATOM 0 HB2 LEU A 687 14.125 -0.230 -6.063 1.00 0.00 H new ATOM 0 HB3 LEU A 687 14.047 -1.902 -5.544 1.00 0.00 H new ATOM 0 HG LEU A 687 12.208 -0.600 -7.611 1.00 0.00 H new ATOM 0 HD11 LEU A 687 13.373 -2.105 -9.202 1.00 0.00 H new ATOM 0 HD12 LEU A 687 14.519 -0.990 -8.422 1.00 0.00 H new ATOM 0 HD13 LEU A 687 14.422 -2.684 -7.886 1.00 0.00 H new ATOM 0 HD21 LEU A 687 11.366 -2.912 -7.953 1.00 0.00 H new ATOM 0 HD22 LEU A 687 12.416 -3.488 -6.636 1.00 0.00 H new ATOM 0 HD23 LEU A 687 11.079 -2.369 -6.283 1.00 0.00 H new ATOM 929 N LEU A 688 13.484 0.934 -3.475 1.00 0.00 N ATOM 930 CA LEU A 688 14.115 1.402 -2.250 1.00 0.00 C ATOM 931 C LEU A 688 13.066 1.525 -1.152 1.00 0.00 C ATOM 932 O LEU A 688 13.342 1.259 0.018 1.00 0.00 O ATOM 933 CB LEU A 688 14.818 2.747 -2.488 1.00 0.00 C ATOM 934 CG LEU A 688 13.932 3.899 -2.014 1.00 0.00 C ATOM 935 CD1 LEU A 688 13.995 3.998 -0.487 1.00 0.00 C ATOM 936 CD2 LEU A 688 14.427 5.212 -2.628 1.00 0.00 C ATOM 0 H LEU A 688 13.427 1.627 -4.221 1.00 0.00 H new ATOM 0 HA LEU A 688 14.870 0.681 -1.936 1.00 0.00 H new ATOM 0 HB2 LEU A 688 15.769 2.767 -1.956 1.00 0.00 H new ATOM 0 HB3 LEU A 688 15.044 2.865 -3.548 1.00 0.00 H new ATOM 0 HG LEU A 688 12.904 3.716 -2.326 1.00 0.00 H new ATOM 0 HD11 LEU A 688 13.363 4.820 -0.149 1.00 0.00 H new ATOM 0 HD12 LEU A 688 13.643 3.065 -0.047 1.00 0.00 H new ATOM 0 HD13 LEU A 688 15.024 4.180 -0.176 1.00 0.00 H new ATOM 0 HD21 LEU A 688 13.795 6.033 -2.290 1.00 0.00 H new ATOM 0 HD22 LEU A 688 15.456 5.394 -2.317 1.00 0.00 H new ATOM 0 HD23 LEU A 688 14.383 5.145 -3.715 1.00 0.00 H new ATOM 948 N LEU A 689 11.853 1.908 -1.543 1.00 0.00 N ATOM 949 CA LEU A 689 10.765 2.035 -0.585 1.00 0.00 C ATOM 950 C LEU A 689 10.538 0.695 0.099 1.00 0.00 C ATOM 951 O LEU A 689 10.336 0.628 1.310 1.00 0.00 O ATOM 952 CB LEU A 689 9.485 2.472 -1.303 1.00 0.00 C ATOM 953 CG LEU A 689 8.410 2.828 -0.273 1.00 0.00 C ATOM 954 CD1 LEU A 689 7.451 3.852 -0.879 1.00 0.00 C ATOM 955 CD2 LEU A 689 7.626 1.569 0.117 1.00 0.00 C ATOM 0 H LEU A 689 11.603 2.133 -2.506 1.00 0.00 H new ATOM 0 HA LEU A 689 11.026 2.786 0.161 1.00 0.00 H new ATOM 0 HB2 LEU A 689 9.690 3.332 -1.941 1.00 0.00 H new ATOM 0 HB3 LEU A 689 9.129 1.672 -1.952 1.00 0.00 H new ATOM 0 HG LEU A 689 8.885 3.246 0.615 1.00 0.00 H new ATOM 0 HD11 LEU A 689 6.684 4.108 -0.149 1.00 0.00 H new ATOM 0 HD12 LEU A 689 8.004 4.750 -1.155 1.00 0.00 H new ATOM 0 HD13 LEU A 689 6.980 3.429 -1.767 1.00 0.00 H new ATOM 0 HD21 LEU A 689 6.862 1.828 0.850 1.00 0.00 H new ATOM 0 HD22 LEU A 689 7.150 1.148 -0.769 1.00 0.00 H new ATOM 0 HD23 LEU A 689 8.307 0.835 0.547 1.00 0.00 H new ATOM 967 N LEU A 690 10.592 -0.373 -0.692 1.00 0.00 N ATOM 968 CA LEU A 690 10.408 -1.716 -0.160 1.00 0.00 C ATOM 969 C LEU A 690 11.467 -2.011 0.893 1.00 0.00 C ATOM 970 O LEU A 690 11.169 -2.572 1.949 1.00 0.00 O ATOM 971 CB LEU A 690 10.510 -2.741 -1.294 1.00 0.00 C ATOM 972 CG LEU A 690 10.285 -4.150 -0.742 1.00 0.00 C ATOM 973 CD1 LEU A 690 8.836 -4.288 -0.274 1.00 0.00 C ATOM 974 CD2 LEU A 690 10.562 -5.179 -1.844 1.00 0.00 C ATOM 0 H LEU A 690 10.761 -0.334 -1.697 1.00 0.00 H new ATOM 0 HA LEU A 690 9.422 -1.782 0.299 1.00 0.00 H new ATOM 0 HB2 LEU A 690 9.771 -2.520 -2.064 1.00 0.00 H new ATOM 0 HB3 LEU A 690 11.490 -2.678 -1.766 1.00 0.00 H new ATOM 0 HG LEU A 690 10.958 -4.323 0.098 1.00 0.00 H new ATOM 0 HD11 LEU A 690 8.675 -5.292 0.119 1.00 0.00 H new ATOM 0 HD12 LEU A 690 8.635 -3.555 0.507 1.00 0.00 H new ATOM 0 HD13 LEU A 690 8.164 -4.116 -1.115 1.00 0.00 H new ATOM 0 HD21 LEU A 690 10.402 -6.184 -1.452 1.00 0.00 H new ATOM 0 HD22 LEU A 690 9.887 -5.005 -2.682 1.00 0.00 H new ATOM 0 HD23 LEU A 690 11.594 -5.081 -2.182 1.00 0.00 H new ATOM 986 N GLN A 691 12.706 -1.626 0.601 1.00 0.00 N ATOM 987 CA GLN A 691 13.801 -1.856 1.536 1.00 0.00 C ATOM 988 C GLN A 691 13.560 -1.111 2.847 1.00 0.00 C ATOM 989 O GLN A 691 13.783 -1.654 3.929 1.00 0.00 O ATOM 990 CB GLN A 691 15.120 -1.383 0.924 1.00 0.00 C ATOM 991 CG GLN A 691 15.425 -2.197 -0.335 1.00 0.00 C ATOM 992 CD GLN A 691 16.721 -1.702 -0.968 1.00 0.00 C ATOM 993 OE1 GLN A 691 17.284 -0.700 -0.527 1.00 0.00 O ATOM 994 NE2 GLN A 691 17.231 -2.346 -1.983 1.00 0.00 N ATOM 0 H GLN A 691 12.974 -1.159 -0.265 1.00 0.00 H new ATOM 0 HA GLN A 691 13.853 -2.925 1.741 1.00 0.00 H new ATOM 0 HB2 GLN A 691 15.058 -0.323 0.677 1.00 0.00 H new ATOM 0 HB3 GLN A 691 15.928 -1.496 1.646 1.00 0.00 H new ATOM 0 HG2 GLN A 691 15.513 -3.254 -0.084 1.00 0.00 H new ATOM 0 HG3 GLN A 691 14.604 -2.106 -1.046 1.00 0.00 H new ATOM 0 HE21 GLN A 691 16.763 -3.176 -2.347 1.00 0.00 H new ATOM 0 HE22 GLN A 691 18.097 -2.019 -2.411 1.00 0.00 H new ATOM 1003 N HIS A 692 13.103 0.135 2.744 1.00 0.00 N ATOM 1004 CA HIS A 692 12.838 0.940 3.932 1.00 0.00 C ATOM 1005 C HIS A 692 11.826 0.241 4.832 1.00 0.00 C ATOM 1006 O HIS A 692 12.031 0.120 6.040 1.00 0.00 O ATOM 1007 CB HIS A 692 12.301 2.315 3.522 1.00 0.00 C ATOM 1008 CG HIS A 692 12.184 3.197 4.735 1.00 0.00 C ATOM 1009 ND1 HIS A 692 11.066 3.982 4.972 1.00 0.00 N ATOM 1010 CD2 HIS A 692 13.037 3.434 5.785 1.00 0.00 C ATOM 1011 CE1 HIS A 692 11.274 4.648 6.123 1.00 0.00 C ATOM 1012 NE2 HIS A 692 12.459 4.350 6.660 1.00 0.00 N ATOM 0 H HIS A 692 12.910 0.605 1.859 1.00 0.00 H new ATOM 0 HA HIS A 692 13.771 1.066 4.482 1.00 0.00 H new ATOM 0 HB2 HIS A 692 12.967 2.773 2.791 1.00 0.00 H new ATOM 0 HB3 HIS A 692 11.328 2.208 3.043 1.00 0.00 H new ATOM 0 HD2 HIS A 692 14.008 2.979 5.913 1.00 0.00 H new ATOM 0 HE1 HIS A 692 10.568 5.339 6.559 1.00 0.00 H new ATOM 0 HE2 HIS A 692 12.856 4.715 7.526 1.00 0.00 H new ATOM 1021 N LEU A 693 10.737 -0.220 4.232 1.00 0.00 N ATOM 1022 CA LEU A 693 9.697 -0.911 4.983 1.00 0.00 C ATOM 1023 C LEU A 693 10.274 -2.099 5.749 1.00 0.00 C ATOM 1024 O LEU A 693 9.858 -2.382 6.872 1.00 0.00 O ATOM 1025 CB LEU A 693 8.604 -1.389 4.029 1.00 0.00 C ATOM 1026 CG LEU A 693 7.981 -0.181 3.328 1.00 0.00 C ATOM 1027 CD1 LEU A 693 6.909 -0.654 2.348 1.00 0.00 C ATOM 1028 CD2 LEU A 693 7.345 0.740 4.371 1.00 0.00 C ATOM 0 H LEU A 693 10.551 -0.129 3.233 1.00 0.00 H new ATOM 0 HA LEU A 693 9.272 -0.214 5.705 1.00 0.00 H new ATOM 0 HB2 LEU A 693 9.023 -2.075 3.293 1.00 0.00 H new ATOM 0 HB3 LEU A 693 7.840 -1.939 4.579 1.00 0.00 H new ATOM 0 HG LEU A 693 8.755 0.361 2.785 1.00 0.00 H new ATOM 0 HD11 LEU A 693 6.466 0.208 1.849 1.00 0.00 H new ATOM 0 HD12 LEU A 693 7.360 -1.311 1.604 1.00 0.00 H new ATOM 0 HD13 LEU A 693 6.135 -1.197 2.890 1.00 0.00 H new ATOM 0 HD21 LEU A 693 6.900 1.602 3.873 1.00 0.00 H new ATOM 0 HD22 LEU A 693 6.572 0.196 4.914 1.00 0.00 H new ATOM 0 HD23 LEU A 693 8.109 1.080 5.071 1.00 0.00 H new ATOM 1040 N ARG A 694 11.227 -2.796 5.135 1.00 0.00 N ATOM 1041 CA ARG A 694 11.837 -3.956 5.779 1.00 0.00 C ATOM 1042 C ARG A 694 12.573 -3.548 7.051 1.00 0.00 C ATOM 1043 O ARG A 694 12.515 -4.247 8.062 1.00 0.00 O ATOM 1044 CB ARG A 694 12.814 -4.643 4.826 1.00 0.00 C ATOM 1045 CG ARG A 694 13.360 -5.906 5.495 1.00 0.00 C ATOM 1046 CD ARG A 694 14.358 -6.593 4.563 1.00 0.00 C ATOM 1047 NE ARG A 694 13.673 -7.100 3.380 1.00 0.00 N ATOM 1048 CZ ARG A 694 14.281 -7.148 2.200 1.00 0.00 C ATOM 1049 NH1 ARG A 694 15.515 -6.737 2.085 1.00 0.00 N ATOM 1050 NH2 ARG A 694 13.646 -7.607 1.157 1.00 0.00 N ATOM 0 H ARG A 694 11.589 -2.582 4.206 1.00 0.00 H new ATOM 0 HA ARG A 694 11.038 -4.650 6.041 1.00 0.00 H new ATOM 0 HB2 ARG A 694 12.312 -4.899 3.893 1.00 0.00 H new ATOM 0 HB3 ARG A 694 13.631 -3.967 4.574 1.00 0.00 H new ATOM 0 HG2 ARG A 694 13.845 -5.650 6.437 1.00 0.00 H new ATOM 0 HG3 ARG A 694 12.542 -6.586 5.732 1.00 0.00 H new ATOM 0 HD2 ARG A 694 15.136 -5.889 4.268 1.00 0.00 H new ATOM 0 HD3 ARG A 694 14.851 -7.412 5.086 1.00 0.00 H new ATOM 0 HE ARG A 694 12.709 -7.424 3.460 1.00 0.00 H new ATOM 0 HH11 ARG A 694 16.012 -6.379 2.901 1.00 0.00 H new ATOM 0 HH12 ARG A 694 15.982 -6.774 1.179 1.00 0.00 H new ATOM 0 HH21 ARG A 694 12.682 -7.929 1.248 1.00 0.00 H new ATOM 0 HH22 ARG A 694 14.113 -7.644 0.251 1.00 0.00 H new ATOM 1064 N GLU A 695 13.266 -2.416 6.994 1.00 0.00 N ATOM 1065 CA GLU A 695 14.009 -1.931 8.152 1.00 0.00 C ATOM 1066 C GLU A 695 13.055 -1.487 9.257 1.00 0.00 C ATOM 1067 O GLU A 695 13.354 -1.630 10.442 1.00 0.00 O ATOM 1068 CB GLU A 695 14.904 -0.762 7.742 1.00 0.00 C ATOM 1069 CG GLU A 695 16.005 -1.269 6.808 1.00 0.00 C ATOM 1070 CD GLU A 695 16.925 -0.119 6.414 1.00 0.00 C ATOM 1071 OE1 GLU A 695 16.585 1.015 6.708 1.00 0.00 O ATOM 1072 OE2 GLU A 695 17.957 -0.390 5.822 1.00 0.00 O ATOM 0 H GLU A 695 13.329 -1.822 6.167 1.00 0.00 H new ATOM 0 HA GLU A 695 14.626 -2.745 8.532 1.00 0.00 H new ATOM 0 HB2 GLU A 695 14.313 0.005 7.242 1.00 0.00 H new ATOM 0 HB3 GLU A 695 15.345 -0.300 8.625 1.00 0.00 H new ATOM 0 HG2 GLU A 695 16.580 -2.053 7.302 1.00 0.00 H new ATOM 0 HG3 GLU A 695 15.561 -1.713 5.917 1.00 0.00 H new ATOM 1079 N HIS A 696 11.907 -0.950 8.860 1.00 0.00 N ATOM 1080 CA HIS A 696 10.914 -0.490 9.824 1.00 0.00 C ATOM 1081 C HIS A 696 9.845 -1.558 10.050 1.00 0.00 C ATOM 1082 O HIS A 696 8.907 -1.358 10.821 1.00 0.00 O ATOM 1083 CB HIS A 696 10.266 0.804 9.328 1.00 0.00 C ATOM 1084 CG HIS A 696 11.226 1.946 9.527 1.00 0.00 C ATOM 1085 ND1 HIS A 696 10.948 3.005 10.379 1.00 0.00 N ATOM 1086 CD2 HIS A 696 12.470 2.203 9.004 1.00 0.00 C ATOM 1087 CE1 HIS A 696 12.002 3.841 10.343 1.00 0.00 C ATOM 1088 NE2 HIS A 696 12.957 3.400 9.522 1.00 0.00 N ATOM 0 H HIS A 696 11.642 -0.823 7.883 1.00 0.00 H new ATOM 0 HA HIS A 696 11.415 -0.299 10.773 1.00 0.00 H new ATOM 0 HB2 HIS A 696 10.004 0.713 8.274 1.00 0.00 H new ATOM 0 HB3 HIS A 696 9.340 0.993 9.871 1.00 0.00 H new ATOM 0 HD2 HIS A 696 12.991 1.573 8.299 1.00 0.00 H new ATOM 0 HE1 HIS A 696 12.067 4.758 10.910 1.00 0.00 H new ATOM 0 HE2 HIS A 696 13.852 3.845 9.318 1.00 0.00 H new ATOM 1168 N PRO A 702 3.318 -2.341 13.140 1.00 0.00 N ATOM 1169 CA PRO A 702 3.672 -2.267 11.696 1.00 0.00 C ATOM 1170 C PRO A 702 2.429 -2.192 10.809 1.00 0.00 C ATOM 1171 O PRO A 702 1.476 -2.946 11.003 1.00 0.00 O ATOM 1172 CB PRO A 702 4.446 -3.564 11.434 1.00 0.00 C ATOM 1173 CG PRO A 702 4.050 -4.492 12.533 1.00 0.00 C ATOM 1174 CD PRO A 702 3.727 -3.615 13.739 1.00 0.00 C ATOM 0 HA PRO A 702 4.249 -1.372 11.465 1.00 0.00 H new ATOM 0 HB2 PRO A 702 4.195 -3.981 10.459 1.00 0.00 H new ATOM 0 HB3 PRO A 702 5.522 -3.387 11.438 1.00 0.00 H new ATOM 0 HG2 PRO A 702 3.185 -5.090 12.244 1.00 0.00 H new ATOM 0 HG3 PRO A 702 4.856 -5.188 12.763 1.00 0.00 H new ATOM 0 HD2 PRO A 702 2.931 -4.046 14.346 1.00 0.00 H new ATOM 0 HD3 PRO A 702 4.593 -3.492 14.389 1.00 0.00 H new ATOM 1182 N PRO A 703 2.420 -1.308 9.846 1.00 0.00 N ATOM 1183 CA PRO A 703 1.265 -1.148 8.918 1.00 0.00 C ATOM 1184 C PRO A 703 1.187 -2.285 7.905 1.00 0.00 C ATOM 1185 O PRO A 703 2.207 -2.862 7.528 1.00 0.00 O ATOM 1186 CB PRO A 703 1.540 0.186 8.224 1.00 0.00 C ATOM 1187 CG PRO A 703 3.021 0.364 8.279 1.00 0.00 C ATOM 1188 CD PRO A 703 3.508 -0.366 9.533 1.00 0.00 C ATOM 0 HA PRO A 703 0.309 -1.169 9.442 1.00 0.00 H new ATOM 0 HB2 PRO A 703 1.184 0.174 7.194 1.00 0.00 H new ATOM 0 HB3 PRO A 703 1.027 1.005 8.729 1.00 0.00 H new ATOM 0 HG2 PRO A 703 3.493 -0.045 7.386 1.00 0.00 H new ATOM 0 HG3 PRO A 703 3.282 1.421 8.321 1.00 0.00 H new ATOM 0 HD2 PRO A 703 4.447 -0.888 9.351 1.00 0.00 H new ATOM 0 HD3 PRO A 703 3.683 0.328 10.355 1.00 0.00 H new ATOM 1196 N LEU A 704 -0.026 -2.602 7.464 1.00 0.00 N ATOM 1197 CA LEU A 704 -0.213 -3.671 6.492 1.00 0.00 C ATOM 1198 C LEU A 704 0.148 -3.176 5.096 1.00 0.00 C ATOM 1199 O LEU A 704 -0.177 -2.048 4.726 1.00 0.00 O ATOM 1200 CB LEU A 704 -1.667 -4.145 6.512 1.00 0.00 C ATOM 1201 CG LEU A 704 -2.058 -4.520 7.943 1.00 0.00 C ATOM 1202 CD1 LEU A 704 -3.482 -5.079 7.955 1.00 0.00 C ATOM 1203 CD2 LEU A 704 -1.092 -5.581 8.477 1.00 0.00 C ATOM 0 H LEU A 704 -0.885 -2.139 7.761 1.00 0.00 H new ATOM 0 HA LEU A 704 0.439 -4.504 6.754 1.00 0.00 H new ATOM 0 HB2 LEU A 704 -2.323 -3.359 6.138 1.00 0.00 H new ATOM 0 HB3 LEU A 704 -1.790 -5.004 5.852 1.00 0.00 H new ATOM 0 HG LEU A 704 -2.010 -3.633 8.574 1.00 0.00 H new ATOM 0 HD11 LEU A 704 -3.760 -5.346 8.975 1.00 0.00 H new ATOM 0 HD12 LEU A 704 -4.172 -4.325 7.577 1.00 0.00 H new ATOM 0 HD13 LEU A 704 -3.530 -5.965 7.322 1.00 0.00 H new ATOM 0 HD21 LEU A 704 -1.371 -5.847 9.496 1.00 0.00 H new ATOM 0 HD22 LEU A 704 -1.139 -6.467 7.844 1.00 0.00 H new ATOM 0 HD23 LEU A 704 -0.077 -5.185 8.471 1.00 0.00 H new ATOM 1215 N VAL A 705 0.831 -4.019 4.329 1.00 0.00 N ATOM 1216 CA VAL A 705 1.237 -3.640 2.983 1.00 0.00 C ATOM 1217 C VAL A 705 0.565 -4.520 1.932 1.00 0.00 C ATOM 1218 O VAL A 705 0.607 -5.751 2.010 1.00 0.00 O ATOM 1219 CB VAL A 705 2.757 -3.758 2.850 1.00 0.00 C ATOM 1220 CG1 VAL A 705 3.196 -3.213 1.490 1.00 0.00 C ATOM 1221 CG2 VAL A 705 3.432 -2.951 3.963 1.00 0.00 C ATOM 0 H VAL A 705 1.112 -4.958 4.613 1.00 0.00 H new ATOM 0 HA VAL A 705 0.927 -2.608 2.815 1.00 0.00 H new ATOM 0 HB VAL A 705 3.047 -4.806 2.932 1.00 0.00 H new ATOM 0 HG11 VAL A 705 4.279 -3.298 1.396 1.00 0.00 H new ATOM 0 HG12 VAL A 705 2.717 -3.787 0.696 1.00 0.00 H new ATOM 0 HG13 VAL A 705 2.905 -2.166 1.407 1.00 0.00 H new ATOM 0 HG21 VAL A 705 4.515 -3.035 3.868 1.00 0.00 H new ATOM 0 HG22 VAL A 705 3.141 -1.904 3.881 1.00 0.00 H new ATOM 0 HG23 VAL A 705 3.122 -3.339 4.933 1.00 0.00 H new ATOM 1231 N LEU A 706 -0.040 -3.875 0.939 1.00 0.00 N ATOM 1232 CA LEU A 706 -0.703 -4.594 -0.141 1.00 0.00 C ATOM 1233 C LEU A 706 -0.011 -4.282 -1.467 1.00 0.00 C ATOM 1234 O LEU A 706 0.331 -3.131 -1.737 1.00 0.00 O ATOM 1235 CB LEU A 706 -2.179 -4.193 -0.215 1.00 0.00 C ATOM 1236 CG LEU A 706 -2.845 -4.440 1.142 1.00 0.00 C ATOM 1237 CD1 LEU A 706 -2.737 -3.181 2.005 1.00 0.00 C ATOM 1238 CD2 LEU A 706 -4.322 -4.786 0.932 1.00 0.00 C ATOM 0 H LEU A 706 -0.084 -2.859 0.861 1.00 0.00 H new ATOM 0 HA LEU A 706 -0.641 -5.665 0.054 1.00 0.00 H new ATOM 0 HB2 LEU A 706 -2.268 -3.142 -0.489 1.00 0.00 H new ATOM 0 HB3 LEU A 706 -2.685 -4.769 -0.990 1.00 0.00 H new ATOM 0 HG LEU A 706 -2.344 -5.268 1.643 1.00 0.00 H new ATOM 0 HD11 LEU A 706 -3.212 -3.359 2.970 1.00 0.00 H new ATOM 0 HD12 LEU A 706 -1.686 -2.933 2.158 1.00 0.00 H new ATOM 0 HD13 LEU A 706 -3.236 -2.352 1.503 1.00 0.00 H new ATOM 0 HD21 LEU A 706 -4.795 -4.962 1.898 1.00 0.00 H new ATOM 0 HD22 LEU A 706 -4.821 -3.958 0.428 1.00 0.00 H new ATOM 0 HD23 LEU A 706 -4.402 -5.685 0.320 1.00 0.00 H new ATOM 1250 N PHE A 707 0.206 -5.306 -2.286 1.00 0.00 N ATOM 1251 CA PHE A 707 0.874 -5.105 -3.569 1.00 0.00 C ATOM 1252 C PHE A 707 -0.080 -5.307 -4.741 1.00 0.00 C ATOM 1253 O PHE A 707 -0.872 -6.250 -4.762 1.00 0.00 O ATOM 1254 CB PHE A 707 2.055 -6.067 -3.702 1.00 0.00 C ATOM 1255 CG PHE A 707 3.126 -5.687 -2.709 1.00 0.00 C ATOM 1256 CD1 PHE A 707 4.073 -4.709 -3.040 1.00 0.00 C ATOM 1257 CD2 PHE A 707 3.171 -6.310 -1.459 1.00 0.00 C ATOM 1258 CE1 PHE A 707 5.066 -4.356 -2.118 1.00 0.00 C ATOM 1259 CE2 PHE A 707 4.163 -5.959 -0.537 1.00 0.00 C ATOM 1260 CZ PHE A 707 5.111 -4.982 -0.866 1.00 0.00 C ATOM 0 H PHE A 707 -0.066 -6.269 -2.090 1.00 0.00 H new ATOM 0 HA PHE A 707 1.230 -4.075 -3.595 1.00 0.00 H new ATOM 0 HB2 PHE A 707 1.726 -7.091 -3.524 1.00 0.00 H new ATOM 0 HB3 PHE A 707 2.454 -6.032 -4.716 1.00 0.00 H new ATOM 0 HD1 PHE A 707 4.037 -4.227 -4.006 1.00 0.00 H new ATOM 0 HD2 PHE A 707 2.440 -7.063 -1.205 1.00 0.00 H new ATOM 0 HE1 PHE A 707 5.796 -3.602 -2.372 1.00 0.00 H new ATOM 0 HE2 PHE A 707 4.198 -6.442 0.429 1.00 0.00 H new ATOM 0 HZ PHE A 707 5.877 -4.711 -0.154 1.00 0.00 H new ATOM 1270 N LEU A 708 0.019 -4.412 -5.721 1.00 0.00 N ATOM 1271 CA LEU A 708 -0.820 -4.486 -6.913 1.00 0.00 C ATOM 1272 C LEU A 708 -0.075 -5.185 -8.047 1.00 0.00 C ATOM 1273 O LEU A 708 1.156 -5.206 -8.070 1.00 0.00 O ATOM 1274 CB LEU A 708 -1.225 -3.081 -7.364 1.00 0.00 C ATOM 1275 CG LEU A 708 -1.871 -2.335 -6.198 1.00 0.00 C ATOM 1276 CD1 LEU A 708 -2.337 -0.958 -6.672 1.00 0.00 C ATOM 1277 CD2 LEU A 708 -3.076 -3.131 -5.693 1.00 0.00 C ATOM 0 H LEU A 708 0.671 -3.628 -5.713 1.00 0.00 H new ATOM 0 HA LEU A 708 -1.714 -5.058 -6.665 1.00 0.00 H new ATOM 0 HB2 LEU A 708 -0.350 -2.535 -7.718 1.00 0.00 H new ATOM 0 HB3 LEU A 708 -1.922 -3.143 -8.200 1.00 0.00 H new ATOM 0 HG LEU A 708 -1.146 -2.218 -5.393 1.00 0.00 H new ATOM 0 HD11 LEU A 708 -2.798 -0.424 -5.841 1.00 0.00 H new ATOM 0 HD12 LEU A 708 -1.481 -0.390 -7.038 1.00 0.00 H new ATOM 0 HD13 LEU A 708 -3.064 -1.077 -7.475 1.00 0.00 H new ATOM 0 HD21 LEU A 708 -3.539 -2.601 -4.861 1.00 0.00 H new ATOM 0 HD22 LEU A 708 -3.801 -3.245 -6.499 1.00 0.00 H new ATOM 0 HD23 LEU A 708 -2.748 -4.115 -5.359 1.00 0.00 H new ATOM 1289 N GLY A 709 -0.824 -5.749 -8.989 1.00 0.00 N ATOM 1290 CA GLY A 709 -0.214 -6.436 -10.124 1.00 0.00 C ATOM 1291 C GLY A 709 0.115 -7.885 -9.783 1.00 0.00 C ATOM 1292 O GLY A 709 -0.663 -8.568 -9.119 1.00 0.00 O ATOM 0 H GLY A 709 -1.844 -5.745 -8.991 1.00 0.00 H new ATOM 0 HA2 GLY A 709 -0.892 -6.406 -10.977 1.00 0.00 H new ATOM 0 HA3 GLY A 709 0.696 -5.915 -10.421 1.00 0.00 H new ATOM 1296 N GLU A 710 1.267 -8.351 -10.250 1.00 0.00 N ATOM 1297 CA GLU A 710 1.676 -9.727 -9.996 1.00 0.00 C ATOM 1298 C GLU A 710 2.434 -9.837 -8.676 1.00 0.00 C ATOM 1299 O GLU A 710 3.094 -8.892 -8.244 1.00 0.00 O ATOM 1300 CB GLU A 710 2.555 -10.225 -11.142 1.00 0.00 C ATOM 1301 CG GLU A 710 1.702 -10.361 -12.403 1.00 0.00 C ATOM 1302 CD GLU A 710 2.555 -10.863 -13.562 1.00 0.00 C ATOM 1303 OE1 GLU A 710 3.686 -11.248 -13.318 1.00 0.00 O ATOM 1304 OE2 GLU A 710 2.064 -10.852 -14.679 1.00 0.00 O ATOM 0 H GLU A 710 1.928 -7.803 -10.801 1.00 0.00 H new ATOM 0 HA GLU A 710 0.780 -10.345 -9.929 1.00 0.00 H new ATOM 0 HB2 GLU A 710 3.376 -9.529 -11.316 1.00 0.00 H new ATOM 0 HB3 GLU A 710 3.001 -11.186 -10.884 1.00 0.00 H new ATOM 0 HG2 GLU A 710 0.879 -11.052 -12.222 1.00 0.00 H new ATOM 0 HG3 GLU A 710 1.260 -9.398 -12.658 1.00 0.00 H new ATOM 1311 N PRO A 711 2.339 -10.969 -8.031 1.00 0.00 N ATOM 1312 CA PRO A 711 3.017 -11.219 -6.725 1.00 0.00 C ATOM 1313 C PRO A 711 4.523 -11.442 -6.878 1.00 0.00 C ATOM 1314 O PRO A 711 4.971 -12.026 -7.865 1.00 0.00 O ATOM 1315 CB PRO A 711 2.339 -12.489 -6.212 1.00 0.00 C ATOM 1316 CG PRO A 711 1.891 -13.213 -7.437 1.00 0.00 C ATOM 1317 CD PRO A 711 1.569 -12.142 -8.479 1.00 0.00 C ATOM 0 HA PRO A 711 2.926 -10.367 -6.052 1.00 0.00 H new ATOM 0 HB2 PRO A 711 3.030 -13.095 -5.626 1.00 0.00 H new ATOM 0 HB3 PRO A 711 1.495 -12.251 -5.564 1.00 0.00 H new ATOM 0 HG2 PRO A 711 2.670 -13.884 -7.798 1.00 0.00 H new ATOM 0 HG3 PRO A 711 1.015 -13.826 -7.227 1.00 0.00 H new ATOM 0 HD2 PRO A 711 1.866 -12.456 -9.480 1.00 0.00 H new ATOM 0 HD3 PRO A 711 0.501 -11.928 -8.516 1.00 0.00 H new ATOM 1325 N PRO A 712 5.306 -11.012 -5.918 1.00 0.00 N ATOM 1326 CA PRO A 712 6.784 -11.200 -5.954 1.00 0.00 C ATOM 1327 C PRO A 712 7.148 -12.655 -6.236 1.00 0.00 C ATOM 1328 O PRO A 712 6.370 -13.562 -5.944 1.00 0.00 O ATOM 1329 CB PRO A 712 7.251 -10.790 -4.555 1.00 0.00 C ATOM 1330 CG PRO A 712 6.177 -9.912 -4.003 1.00 0.00 C ATOM 1331 CD PRO A 712 4.873 -10.296 -4.704 1.00 0.00 C ATOM 0 HA PRO A 712 7.254 -10.614 -6.744 1.00 0.00 H new ATOM 0 HB2 PRO A 712 7.403 -11.665 -3.923 1.00 0.00 H new ATOM 0 HB3 PRO A 712 8.203 -10.260 -4.601 1.00 0.00 H new ATOM 0 HG2 PRO A 712 6.088 -10.045 -2.925 1.00 0.00 H new ATOM 0 HG3 PRO A 712 6.412 -8.862 -4.176 1.00 0.00 H new ATOM 0 HD2 PRO A 712 4.252 -10.929 -4.070 1.00 0.00 H new ATOM 0 HD3 PRO A 712 4.281 -9.415 -4.952 1.00 0.00 H new ATOM 1339 N VAL A 713 8.328 -12.874 -6.803 1.00 0.00 N ATOM 1340 CA VAL A 713 8.762 -14.230 -7.112 1.00 0.00 C ATOM 1341 C VAL A 713 9.248 -14.935 -5.851 1.00 0.00 C ATOM 1342 O VAL A 713 8.923 -16.099 -5.617 1.00 0.00 O ATOM 1343 CB VAL A 713 9.878 -14.200 -8.155 1.00 0.00 C ATOM 1344 CG1 VAL A 713 10.489 -15.596 -8.286 1.00 0.00 C ATOM 1345 CG2 VAL A 713 9.297 -13.771 -9.504 1.00 0.00 C ATOM 0 H VAL A 713 8.992 -12.142 -7.055 1.00 0.00 H new ATOM 0 HA VAL A 713 7.913 -14.781 -7.515 1.00 0.00 H new ATOM 0 HB VAL A 713 10.648 -13.493 -7.847 1.00 0.00 H new ATOM 0 HG11 VAL A 713 11.285 -15.576 -9.030 1.00 0.00 H new ATOM 0 HG12 VAL A 713 10.898 -15.906 -7.324 1.00 0.00 H new ATOM 0 HG13 VAL A 713 9.719 -16.302 -8.597 1.00 0.00 H new ATOM 0 HG21 VAL A 713 10.090 -13.748 -10.251 1.00 0.00 H new ATOM 0 HG22 VAL A 713 8.529 -14.481 -9.812 1.00 0.00 H new ATOM 0 HG23 VAL A 713 8.857 -12.778 -9.411 1.00 0.00 H new ATOM 1355 N ASP A 714 10.014 -14.221 -5.032 1.00 0.00 N ATOM 1356 CA ASP A 714 10.516 -14.794 -3.790 1.00 0.00 C ATOM 1357 C ASP A 714 9.377 -14.914 -2.776 1.00 0.00 C ATOM 1358 O ASP A 714 8.562 -14.001 -2.645 1.00 0.00 O ATOM 1359 CB ASP A 714 11.623 -13.910 -3.212 1.00 0.00 C ATOM 1360 CG ASP A 714 12.867 -13.989 -4.091 1.00 0.00 C ATOM 1361 OD1 ASP A 714 12.759 -14.499 -5.194 1.00 0.00 O ATOM 1362 OD2 ASP A 714 13.910 -13.538 -3.649 1.00 0.00 O ATOM 0 H ASP A 714 10.298 -13.256 -5.203 1.00 0.00 H new ATOM 0 HA ASP A 714 10.922 -15.784 -3.999 1.00 0.00 H new ATOM 0 HB2 ASP A 714 11.279 -12.878 -3.147 1.00 0.00 H new ATOM 0 HB3 ASP A 714 11.863 -14.230 -2.198 1.00 0.00 H new ATOM 1367 N PRO A 715 9.301 -16.008 -2.061 1.00 0.00 N ATOM 1368 CA PRO A 715 8.231 -16.226 -1.046 1.00 0.00 C ATOM 1369 C PRO A 715 8.479 -15.437 0.236 1.00 0.00 C ATOM 1370 O PRO A 715 7.589 -15.304 1.076 1.00 0.00 O ATOM 1371 CB PRO A 715 8.292 -17.729 -0.782 1.00 0.00 C ATOM 1372 CG PRO A 715 9.704 -18.120 -1.067 1.00 0.00 C ATOM 1373 CD PRO A 715 10.220 -17.156 -2.138 1.00 0.00 C ATOM 0 HA PRO A 715 7.257 -15.886 -1.398 1.00 0.00 H new ATOM 0 HB2 PRO A 715 8.020 -17.959 0.248 1.00 0.00 H new ATOM 0 HB3 PRO A 715 7.597 -18.270 -1.424 1.00 0.00 H new ATOM 0 HG2 PRO A 715 10.312 -18.058 -0.165 1.00 0.00 H new ATOM 0 HG3 PRO A 715 9.757 -19.151 -1.417 1.00 0.00 H new ATOM 0 HD2 PRO A 715 11.249 -16.856 -1.942 1.00 0.00 H new ATOM 0 HD3 PRO A 715 10.204 -17.614 -3.127 1.00 0.00 H new ATOM 1381 N LEU A 716 9.694 -14.918 0.381 1.00 0.00 N ATOM 1382 CA LEU A 716 10.047 -14.148 1.567 1.00 0.00 C ATOM 1383 C LEU A 716 9.322 -12.809 1.578 1.00 0.00 C ATOM 1384 O LEU A 716 8.912 -12.324 2.634 1.00 0.00 O ATOM 1385 CB LEU A 716 11.558 -13.913 1.611 1.00 0.00 C ATOM 1386 CG LEU A 716 11.920 -13.160 2.891 1.00 0.00 C ATOM 1387 CD1 LEU A 716 11.824 -14.108 4.088 1.00 0.00 C ATOM 1388 CD2 LEU A 716 13.350 -12.624 2.781 1.00 0.00 C ATOM 0 H LEU A 716 10.445 -15.016 -0.302 1.00 0.00 H new ATOM 0 HA LEU A 716 9.743 -14.718 2.445 1.00 0.00 H new ATOM 0 HB2 LEU A 716 12.086 -14.866 1.575 1.00 0.00 H new ATOM 0 HB3 LEU A 716 11.873 -13.341 0.738 1.00 0.00 H new ATOM 0 HG LEU A 716 11.228 -12.329 3.029 1.00 0.00 H new ATOM 0 HD11 LEU A 716 12.082 -13.570 5.000 1.00 0.00 H new ATOM 0 HD12 LEU A 716 10.807 -14.491 4.168 1.00 0.00 H new ATOM 0 HD13 LEU A 716 12.515 -14.940 3.950 1.00 0.00 H new ATOM 0 HD21 LEU A 716 13.608 -12.087 3.694 1.00 0.00 H new ATOM 0 HD22 LEU A 716 14.041 -13.456 2.641 1.00 0.00 H new ATOM 0 HD23 LEU A 716 13.420 -11.947 1.929 1.00 0.00 H new ATOM 1400 N LEU A 717 9.160 -12.217 0.402 1.00 0.00 N ATOM 1401 CA LEU A 717 8.477 -10.937 0.300 1.00 0.00 C ATOM 1402 C LEU A 717 6.977 -11.143 0.455 1.00 0.00 C ATOM 1403 O LEU A 717 6.277 -10.306 1.026 1.00 0.00 O ATOM 1404 CB LEU A 717 8.773 -10.291 -1.056 1.00 0.00 C ATOM 1405 CG LEU A 717 10.283 -10.106 -1.215 1.00 0.00 C ATOM 1406 CD1 LEU A 717 10.575 -9.430 -2.556 1.00 0.00 C ATOM 1407 CD2 LEU A 717 10.809 -9.231 -0.075 1.00 0.00 C ATOM 0 H LEU A 717 9.489 -12.599 -0.485 1.00 0.00 H new ATOM 0 HA LEU A 717 8.835 -10.279 1.092 1.00 0.00 H new ATOM 0 HB2 LEU A 717 8.386 -10.916 -1.861 1.00 0.00 H new ATOM 0 HB3 LEU A 717 8.268 -9.328 -1.130 1.00 0.00 H new ATOM 0 HG LEU A 717 10.776 -11.078 -1.185 1.00 0.00 H new ATOM 0 HD11 LEU A 717 11.651 -9.298 -2.670 1.00 0.00 H new ATOM 0 HD12 LEU A 717 10.198 -10.053 -3.367 1.00 0.00 H new ATOM 0 HD13 LEU A 717 10.085 -8.457 -2.587 1.00 0.00 H new ATOM 0 HD21 LEU A 717 11.885 -9.097 -0.186 1.00 0.00 H new ATOM 0 HD22 LEU A 717 10.317 -8.259 -0.106 1.00 0.00 H new ATOM 0 HD23 LEU A 717 10.600 -9.713 0.880 1.00 0.00 H new ATOM 1419 N THR A 718 6.494 -12.278 -0.042 1.00 0.00 N ATOM 1420 CA THR A 718 5.079 -12.605 0.062 1.00 0.00 C ATOM 1421 C THR A 718 4.684 -12.762 1.527 1.00 0.00 C ATOM 1422 O THR A 718 3.639 -12.271 1.954 1.00 0.00 O ATOM 1423 CB THR A 718 4.790 -13.908 -0.691 1.00 0.00 C ATOM 1424 OG1 THR A 718 5.191 -13.767 -2.047 1.00 0.00 O ATOM 1425 CG2 THR A 718 3.294 -14.227 -0.630 1.00 0.00 C ATOM 0 H THR A 718 7.059 -12.982 -0.518 1.00 0.00 H new ATOM 0 HA THR A 718 4.497 -11.796 -0.379 1.00 0.00 H new ATOM 0 HB THR A 718 5.346 -14.722 -0.226 1.00 0.00 H new ATOM 0 HG1 THR A 718 5.009 -14.600 -2.530 1.00 0.00 H new ATOM 0 HG21 THR A 718 3.098 -15.155 -1.168 1.00 0.00 H new ATOM 0 HG22 THR A 718 2.988 -14.339 0.410 1.00 0.00 H new ATOM 0 HG23 THR A 718 2.730 -13.415 -1.089 1.00 0.00 H new ATOM 1433 N ALA A 719 5.531 -13.449 2.293 1.00 0.00 N ATOM 1434 CA ALA A 719 5.261 -13.664 3.710 1.00 0.00 C ATOM 1435 C ALA A 719 5.281 -12.342 4.466 1.00 0.00 C ATOM 1436 O ALA A 719 4.488 -12.127 5.383 1.00 0.00 O ATOM 1437 CB ALA A 719 6.302 -14.614 4.305 1.00 0.00 C ATOM 0 H ALA A 719 6.402 -13.862 1.958 1.00 0.00 H new ATOM 0 HA ALA A 719 4.271 -14.109 3.807 1.00 0.00 H new ATOM 0 HB1 ALA A 719 6.091 -14.768 5.363 1.00 0.00 H new ATOM 0 HB2 ALA A 719 6.261 -15.571 3.784 1.00 0.00 H new ATOM 0 HB3 ALA A 719 7.296 -14.181 4.192 1.00 0.00 H new ATOM 1443 N GLN A 720 6.189 -11.455 4.073 1.00 0.00 N ATOM 1444 CA GLN A 720 6.295 -10.154 4.721 1.00 0.00 C ATOM 1445 C GLN A 720 5.127 -9.265 4.310 1.00 0.00 C ATOM 1446 O GLN A 720 4.715 -8.377 5.056 1.00 0.00 O ATOM 1447 CB GLN A 720 7.619 -9.484 4.345 1.00 0.00 C ATOM 1448 CG GLN A 720 8.780 -10.283 4.942 1.00 0.00 C ATOM 1449 CD GLN A 720 10.111 -9.654 4.543 1.00 0.00 C ATOM 1450 OE1 GLN A 720 10.171 -8.871 3.595 1.00 0.00 O ATOM 1451 NE2 GLN A 720 11.188 -9.956 5.216 1.00 0.00 N ATOM 0 H GLN A 720 6.856 -11.611 3.317 1.00 0.00 H new ATOM 0 HA GLN A 720 6.266 -10.298 5.801 1.00 0.00 H new ATOM 0 HB2 GLN A 720 7.718 -9.432 3.261 1.00 0.00 H new ATOM 0 HB3 GLN A 720 7.639 -8.459 4.716 1.00 0.00 H new ATOM 0 HG2 GLN A 720 8.693 -10.309 6.028 1.00 0.00 H new ATOM 0 HG3 GLN A 720 8.738 -11.315 4.594 1.00 0.00 H new ATOM 0 HE21 GLN A 720 11.134 -10.605 6.001 1.00 0.00 H new ATOM 0 HE22 GLN A 720 12.084 -9.543 4.957 1.00 0.00 H new ATOM 1460 N ALA A 721 4.592 -9.521 3.121 1.00 0.00 N ATOM 1461 CA ALA A 721 3.465 -8.748 2.616 1.00 0.00 C ATOM 1462 C ALA A 721 2.197 -9.088 3.392 1.00 0.00 C ATOM 1463 O ALA A 721 2.030 -10.212 3.864 1.00 0.00 O ATOM 1464 CB ALA A 721 3.253 -9.051 1.131 1.00 0.00 C ATOM 0 H ALA A 721 4.919 -10.254 2.492 1.00 0.00 H new ATOM 0 HA ALA A 721 3.684 -7.688 2.744 1.00 0.00 H new ATOM 0 HB1 ALA A 721 2.409 -8.471 0.758 1.00 0.00 H new ATOM 0 HB2 ALA A 721 4.151 -8.785 0.574 1.00 0.00 H new ATOM 0 HB3 ALA A 721 3.048 -10.114 1.002 1.00 0.00 H new ATOM 1470 N SER A 722 1.304 -8.111 3.517 1.00 0.00 N ATOM 1471 CA SER A 722 0.054 -8.325 4.236 1.00 0.00 C ATOM 1472 C SER A 722 -0.995 -8.922 3.304 1.00 0.00 C ATOM 1473 O SER A 722 -1.859 -9.686 3.734 1.00 0.00 O ATOM 1474 CB SER A 722 -0.457 -7.001 4.803 1.00 0.00 C ATOM 1475 OG SER A 722 -1.460 -7.262 5.777 1.00 0.00 O ATOM 0 H SER A 722 1.421 -7.173 3.134 1.00 0.00 H new ATOM 0 HA SER A 722 0.238 -9.020 5.056 1.00 0.00 H new ATOM 0 HB2 SER A 722 0.365 -6.443 5.251 1.00 0.00 H new ATOM 0 HB3 SER A 722 -0.863 -6.382 4.003 1.00 0.00 H new ATOM 0 HG SER A 722 -2.345 -7.131 5.378 1.00 0.00 H new ATOM 1481 N ALA A 723 -0.910 -8.571 2.024 1.00 0.00 N ATOM 1482 CA ALA A 723 -1.857 -9.083 1.037 1.00 0.00 C ATOM 1483 C ALA A 723 -1.428 -8.684 -0.371 1.00 0.00 C ATOM 1484 O ALA A 723 -0.639 -7.758 -0.548 1.00 0.00 O ATOM 1485 CB ALA A 723 -3.258 -8.542 1.326 1.00 0.00 C ATOM 0 H ALA A 723 -0.202 -7.940 1.648 1.00 0.00 H new ATOM 0 HA ALA A 723 -1.872 -10.171 1.103 1.00 0.00 H new ATOM 0 HB1 ALA A 723 -3.957 -8.929 0.585 1.00 0.00 H new ATOM 0 HB2 ALA A 723 -3.572 -8.858 2.321 1.00 0.00 H new ATOM 0 HB3 ALA A 723 -3.245 -7.453 1.278 1.00 0.00 H new ATOM 1491 N ILE A 724 -1.944 -9.393 -1.372 1.00 0.00 N ATOM 1492 CA ILE A 724 -1.594 -9.100 -2.760 1.00 0.00 C ATOM 1493 C ILE A 724 -2.774 -9.385 -3.686 1.00 0.00 C ATOM 1494 O ILE A 724 -3.267 -10.511 -3.748 1.00 0.00 O ATOM 1495 CB ILE A 724 -0.403 -9.959 -3.191 1.00 0.00 C ATOM 1496 CG1 ILE A 724 0.747 -9.781 -2.195 1.00 0.00 C ATOM 1497 CG2 ILE A 724 0.061 -9.527 -4.585 1.00 0.00 C ATOM 1498 CD1 ILE A 724 1.906 -10.698 -2.588 1.00 0.00 C ATOM 0 H ILE A 724 -2.599 -10.166 -1.251 1.00 0.00 H new ATOM 0 HA ILE A 724 -1.333 -8.044 -2.829 1.00 0.00 H new ATOM 0 HB ILE A 724 -0.704 -11.006 -3.215 1.00 0.00 H new ATOM 0 HG12 ILE A 724 1.078 -8.742 -2.186 1.00 0.00 H new ATOM 0 HG13 ILE A 724 0.409 -10.016 -1.186 1.00 0.00 H new ATOM 0 HG21 ILE A 724 0.909 -10.139 -4.892 1.00 0.00 H new ATOM 0 HG22 ILE A 724 -0.755 -9.655 -5.296 1.00 0.00 H new ATOM 0 HG23 ILE A 724 0.360 -8.479 -4.561 1.00 0.00 H new ATOM 0 HD11 ILE A 724 2.725 -10.573 -1.880 1.00 0.00 H new ATOM 0 HD12 ILE A 724 1.570 -11.735 -2.574 1.00 0.00 H new ATOM 0 HD13 ILE A 724 2.250 -10.441 -3.590 1.00 0.00 H new ATOM 1510 N LEU A 725 -3.220 -8.359 -4.406 1.00 0.00 N ATOM 1511 CA LEU A 725 -4.340 -8.516 -5.328 1.00 0.00 C ATOM 1512 C LEU A 725 -3.880 -8.350 -6.772 1.00 0.00 C ATOM 1513 O LEU A 725 -3.222 -7.366 -7.111 1.00 0.00 O ATOM 1514 CB LEU A 725 -5.415 -7.473 -5.021 1.00 0.00 C ATOM 1515 CG LEU A 725 -5.804 -7.557 -3.546 1.00 0.00 C ATOM 1516 CD1 LEU A 725 -6.929 -6.562 -3.258 1.00 0.00 C ATOM 1517 CD2 LEU A 725 -6.283 -8.975 -3.229 1.00 0.00 C ATOM 0 H LEU A 725 -2.827 -7.418 -4.370 1.00 0.00 H new ATOM 0 HA LEU A 725 -4.749 -9.518 -5.200 1.00 0.00 H new ATOM 0 HB2 LEU A 725 -5.044 -6.475 -5.253 1.00 0.00 H new ATOM 0 HB3 LEU A 725 -6.290 -7.642 -5.649 1.00 0.00 H new ATOM 0 HG LEU A 725 -4.940 -7.316 -2.926 1.00 0.00 H new ATOM 0 HD11 LEU A 725 -7.207 -6.622 -2.206 1.00 0.00 H new ATOM 0 HD12 LEU A 725 -6.589 -5.552 -3.487 1.00 0.00 H new ATOM 0 HD13 LEU A 725 -7.794 -6.802 -3.876 1.00 0.00 H new ATOM 0 HD21 LEU A 725 -6.561 -9.038 -2.177 1.00 0.00 H new ATOM 0 HD22 LEU A 725 -7.148 -9.214 -3.848 1.00 0.00 H new ATOM 0 HD23 LEU A 725 -5.482 -9.684 -3.436 1.00 0.00 H new ATOM 1529 N SER A 726 -4.241 -9.304 -7.625 1.00 0.00 N ATOM 1530 CA SER A 726 -3.866 -9.230 -9.032 1.00 0.00 C ATOM 1531 C SER A 726 -4.604 -8.080 -9.707 1.00 0.00 C ATOM 1532 O SER A 726 -4.036 -7.351 -10.519 1.00 0.00 O ATOM 1533 CB SER A 726 -4.208 -10.541 -9.736 1.00 0.00 C ATOM 1534 OG SER A 726 -3.668 -11.626 -8.993 1.00 0.00 O ATOM 0 H SER A 726 -4.786 -10.128 -7.370 1.00 0.00 H new ATOM 0 HA SER A 726 -2.792 -9.058 -9.100 1.00 0.00 H new ATOM 0 HB2 SER A 726 -5.289 -10.648 -9.825 1.00 0.00 H new ATOM 0 HB3 SER A 726 -3.803 -10.541 -10.748 1.00 0.00 H new ATOM 0 HG SER A 726 -3.887 -12.470 -9.441 1.00 0.00 H new ATOM 1540 N LYS A 727 -5.876 -7.926 -9.354 1.00 0.00 N ATOM 1541 CA LYS A 727 -6.699 -6.862 -9.915 1.00 0.00 C ATOM 1542 C LYS A 727 -7.672 -6.344 -8.861 1.00 0.00 C ATOM 1543 O LYS A 727 -8.161 -7.108 -8.029 1.00 0.00 O ATOM 1544 CB LYS A 727 -7.478 -7.386 -11.123 1.00 0.00 C ATOM 1545 CG LYS A 727 -7.665 -8.898 -10.989 1.00 0.00 C ATOM 1546 CD LYS A 727 -8.973 -9.318 -11.660 1.00 0.00 C ATOM 1547 CE LYS A 727 -9.040 -10.845 -11.721 1.00 0.00 C ATOM 1548 NZ LYS A 727 -10.457 -11.278 -11.871 1.00 0.00 N ATOM 0 H LYS A 727 -6.358 -8.524 -8.683 1.00 0.00 H new ATOM 0 HA LYS A 727 -6.050 -6.046 -10.234 1.00 0.00 H new ATOM 0 HB2 LYS A 727 -8.448 -6.893 -11.186 1.00 0.00 H new ATOM 0 HB3 LYS A 727 -6.942 -7.155 -12.044 1.00 0.00 H new ATOM 0 HG2 LYS A 727 -6.826 -9.420 -11.449 1.00 0.00 H new ATOM 0 HG3 LYS A 727 -7.678 -9.180 -9.936 1.00 0.00 H new ATOM 0 HD2 LYS A 727 -9.824 -8.927 -11.102 1.00 0.00 H new ATOM 0 HD3 LYS A 727 -9.031 -8.899 -12.665 1.00 0.00 H new ATOM 0 HE2 LYS A 727 -8.447 -11.212 -12.559 1.00 0.00 H new ATOM 0 HE3 LYS A 727 -8.612 -11.274 -10.815 1.00 0.00 H new ATOM 0 HZ1 LYS A 727 -10.500 -12.316 -11.912 1.00 0.00 H new ATOM 0 HZ2 LYS A 727 -11.011 -10.940 -11.058 1.00 0.00 H new ATOM 0 HZ3 LYS A 727 -10.851 -10.880 -12.748 1.00 0.00 H new ATOM 1562 N PRO A 728 -7.963 -5.072 -8.878 1.00 0.00 N ATOM 1563 CA PRO A 728 -8.902 -4.458 -7.897 1.00 0.00 C ATOM 1564 C PRO A 728 -10.293 -5.076 -7.987 1.00 0.00 C ATOM 1565 O PRO A 728 -10.867 -5.184 -9.071 1.00 0.00 O ATOM 1566 CB PRO A 728 -8.930 -2.973 -8.278 1.00 0.00 C ATOM 1567 CG PRO A 728 -8.370 -2.891 -9.662 1.00 0.00 C ATOM 1568 CD PRO A 728 -7.437 -4.087 -9.829 1.00 0.00 C ATOM 0 HA PRO A 728 -8.582 -4.619 -6.868 1.00 0.00 H new ATOM 0 HB2 PRO A 728 -9.947 -2.581 -8.245 1.00 0.00 H new ATOM 0 HB3 PRO A 728 -8.337 -2.380 -7.582 1.00 0.00 H new ATOM 0 HG2 PRO A 728 -9.168 -2.916 -10.404 1.00 0.00 H new ATOM 0 HG3 PRO A 728 -7.830 -1.955 -9.806 1.00 0.00 H new ATOM 0 HD2 PRO A 728 -7.453 -4.468 -10.850 1.00 0.00 H new ATOM 0 HD3 PRO A 728 -6.404 -3.824 -9.603 1.00 0.00 H new ATOM 1576 N LEU A 729 -10.827 -5.485 -6.842 1.00 0.00 N ATOM 1577 CA LEU A 729 -12.149 -6.098 -6.802 1.00 0.00 C ATOM 1578 C LEU A 729 -12.526 -6.462 -5.370 1.00 0.00 C ATOM 1579 O LEU A 729 -11.662 -6.769 -4.549 1.00 0.00 O ATOM 1580 CB LEU A 729 -12.166 -7.354 -7.680 1.00 0.00 C ATOM 1581 CG LEU A 729 -13.522 -8.060 -7.566 1.00 0.00 C ATOM 1582 CD1 LEU A 729 -14.599 -7.239 -8.280 1.00 0.00 C ATOM 1583 CD2 LEU A 729 -13.428 -9.442 -8.219 1.00 0.00 C ATOM 0 H LEU A 729 -10.368 -5.404 -5.935 1.00 0.00 H new ATOM 0 HA LEU A 729 -12.877 -5.382 -7.182 1.00 0.00 H new ATOM 0 HB2 LEU A 729 -11.975 -7.084 -8.718 1.00 0.00 H new ATOM 0 HB3 LEU A 729 -11.368 -8.031 -7.375 1.00 0.00 H new ATOM 0 HG LEU A 729 -13.786 -8.163 -6.513 1.00 0.00 H new ATOM 0 HD11 LEU A 729 -15.560 -7.747 -8.195 1.00 0.00 H new ATOM 0 HD12 LEU A 729 -14.668 -6.252 -7.822 1.00 0.00 H new ATOM 0 HD13 LEU A 729 -14.337 -7.132 -9.333 1.00 0.00 H new ATOM 0 HD21 LEU A 729 -14.390 -9.948 -8.140 1.00 0.00 H new ATOM 0 HD22 LEU A 729 -13.162 -9.330 -9.270 1.00 0.00 H new ATOM 0 HD23 LEU A 729 -12.665 -10.033 -7.712 1.00 0.00 H new ATOM 1595 N ASP A 730 -13.822 -6.431 -5.081 1.00 0.00 N ATOM 1596 CA ASP A 730 -14.306 -6.765 -3.746 1.00 0.00 C ATOM 1597 C ASP A 730 -13.668 -5.859 -2.697 1.00 0.00 C ATOM 1598 O ASP A 730 -12.875 -6.307 -1.870 1.00 0.00 O ATOM 1599 CB ASP A 730 -13.985 -8.226 -3.423 1.00 0.00 C ATOM 1600 CG ASP A 730 -15.219 -9.098 -3.643 1.00 0.00 C ATOM 1601 OD1 ASP A 730 -16.318 -8.593 -3.475 1.00 0.00 O ATOM 1602 OD2 ASP A 730 -15.046 -10.260 -3.973 1.00 0.00 O ATOM 0 H ASP A 730 -14.552 -6.180 -5.748 1.00 0.00 H new ATOM 0 HA ASP A 730 -15.386 -6.617 -3.727 1.00 0.00 H new ATOM 0 HB2 ASP A 730 -13.167 -8.574 -4.054 1.00 0.00 H new ATOM 0 HB3 ASP A 730 -13.649 -8.312 -2.390 1.00 0.00 H new ATOM 1607 N PRO A 731 -14.007 -4.600 -2.722 1.00 0.00 N ATOM 1608 CA PRO A 731 -13.470 -3.596 -1.757 1.00 0.00 C ATOM 1609 C PRO A 731 -13.688 -4.021 -0.307 1.00 0.00 C ATOM 1610 O PRO A 731 -13.071 -3.477 0.613 1.00 0.00 O ATOM 1611 CB PRO A 731 -14.260 -2.321 -2.071 1.00 0.00 C ATOM 1612 CG PRO A 731 -14.772 -2.496 -3.462 1.00 0.00 C ATOM 1613 CD PRO A 731 -14.940 -3.998 -3.682 1.00 0.00 C ATOM 0 HA PRO A 731 -12.392 -3.470 -1.861 1.00 0.00 H new ATOM 0 HB2 PRO A 731 -15.080 -2.185 -1.366 1.00 0.00 H new ATOM 0 HB3 PRO A 731 -13.625 -1.438 -1.996 1.00 0.00 H new ATOM 0 HG2 PRO A 731 -15.722 -1.977 -3.593 1.00 0.00 H new ATOM 0 HG3 PRO A 731 -14.076 -2.074 -4.187 1.00 0.00 H new ATOM 0 HD2 PRO A 731 -15.966 -4.317 -3.497 1.00 0.00 H new ATOM 0 HD3 PRO A 731 -14.698 -4.282 -4.706 1.00 0.00 H new ATOM 1621 N GLN A 732 -14.569 -4.996 -0.108 1.00 0.00 N ATOM 1622 CA GLN A 732 -14.860 -5.479 1.236 1.00 0.00 C ATOM 1623 C GLN A 732 -13.665 -6.239 1.793 1.00 0.00 C ATOM 1624 O GLN A 732 -13.400 -6.199 2.995 1.00 0.00 O ATOM 1625 CB GLN A 732 -16.086 -6.395 1.214 1.00 0.00 C ATOM 1626 CG GLN A 732 -17.323 -5.593 0.800 1.00 0.00 C ATOM 1627 CD GLN A 732 -18.544 -6.506 0.751 1.00 0.00 C ATOM 1628 OE1 GLN A 732 -18.421 -7.692 0.444 1.00 0.00 O ATOM 1629 NE2 GLN A 732 -19.723 -6.025 1.044 1.00 0.00 N ATOM 0 H GLN A 732 -15.089 -5.463 -0.852 1.00 0.00 H new ATOM 0 HA GLN A 732 -15.066 -4.620 1.875 1.00 0.00 H new ATOM 0 HB2 GLN A 732 -15.925 -7.218 0.518 1.00 0.00 H new ATOM 0 HB3 GLN A 732 -16.240 -6.836 2.199 1.00 0.00 H new ATOM 0 HG2 GLN A 732 -17.494 -4.781 1.507 1.00 0.00 H new ATOM 0 HG3 GLN A 732 -17.161 -5.136 -0.176 1.00 0.00 H new ATOM 0 HE21 GLN A 732 -19.824 -5.042 1.298 1.00 0.00 H new ATOM 0 HE22 GLN A 732 -20.542 -6.632 1.019 1.00 0.00 H new ATOM 1638 N LEU A 733 -12.940 -6.921 0.913 1.00 0.00 N ATOM 1639 CA LEU A 733 -11.768 -7.673 1.337 1.00 0.00 C ATOM 1640 C LEU A 733 -10.682 -6.718 1.814 1.00 0.00 C ATOM 1641 O LEU A 733 -10.034 -6.959 2.832 1.00 0.00 O ATOM 1642 CB LEU A 733 -11.232 -8.516 0.179 1.00 0.00 C ATOM 1643 CG LEU A 733 -10.067 -9.378 0.674 1.00 0.00 C ATOM 1644 CD1 LEU A 733 -10.601 -10.516 1.548 1.00 0.00 C ATOM 1645 CD2 LEU A 733 -9.320 -9.966 -0.526 1.00 0.00 C ATOM 0 H LEU A 733 -13.141 -6.968 -0.086 1.00 0.00 H new ATOM 0 HA LEU A 733 -12.056 -8.333 2.156 1.00 0.00 H new ATOM 0 HB2 LEU A 733 -12.024 -9.150 -0.221 1.00 0.00 H new ATOM 0 HB3 LEU A 733 -10.901 -7.869 -0.633 1.00 0.00 H new ATOM 0 HG LEU A 733 -9.387 -8.760 1.261 1.00 0.00 H new ATOM 0 HD11 LEU A 733 -9.769 -11.127 1.898 1.00 0.00 H new ATOM 0 HD12 LEU A 733 -11.131 -10.099 2.405 1.00 0.00 H new ATOM 0 HD13 LEU A 733 -11.284 -11.133 0.964 1.00 0.00 H new ATOM 0 HD21 LEU A 733 -8.491 -10.579 -0.173 1.00 0.00 H new ATOM 0 HD22 LEU A 733 -10.002 -10.581 -1.114 1.00 0.00 H new ATOM 0 HD23 LEU A 733 -8.935 -9.157 -1.147 1.00 0.00 H new ATOM 1657 N LEU A 734 -10.496 -5.626 1.077 1.00 0.00 N ATOM 1658 CA LEU A 734 -9.494 -4.637 1.446 1.00 0.00 C ATOM 1659 C LEU A 734 -9.750 -4.138 2.862 1.00 0.00 C ATOM 1660 O LEU A 734 -8.825 -4.011 3.665 1.00 0.00 O ATOM 1661 CB LEU A 734 -9.530 -3.458 0.472 1.00 0.00 C ATOM 1662 CG LEU A 734 -8.438 -2.455 0.848 1.00 0.00 C ATOM 1663 CD1 LEU A 734 -7.064 -3.065 0.564 1.00 0.00 C ATOM 1664 CD2 LEU A 734 -8.611 -1.181 0.018 1.00 0.00 C ATOM 0 H LEU A 734 -11.021 -5.407 0.230 1.00 0.00 H new ATOM 0 HA LEU A 734 -8.511 -5.105 1.402 1.00 0.00 H new ATOM 0 HB2 LEU A 734 -9.380 -3.810 -0.548 1.00 0.00 H new ATOM 0 HB3 LEU A 734 -10.507 -2.977 0.502 1.00 0.00 H new ATOM 0 HG LEU A 734 -8.515 -2.213 1.908 1.00 0.00 H new ATOM 0 HD11 LEU A 734 -6.286 -2.350 0.832 1.00 0.00 H new ATOM 0 HD12 LEU A 734 -6.940 -3.974 1.153 1.00 0.00 H new ATOM 0 HD13 LEU A 734 -6.985 -3.307 -0.496 1.00 0.00 H new ATOM 0 HD21 LEU A 734 -7.834 -0.465 0.284 1.00 0.00 H new ATOM 0 HD22 LEU A 734 -8.533 -1.424 -1.042 1.00 0.00 H new ATOM 0 HD23 LEU A 734 -9.590 -0.746 0.219 1.00 0.00 H new ATOM 1676 N LEU A 735 -11.015 -3.864 3.162 1.00 0.00 N ATOM 1677 CA LEU A 735 -11.383 -3.389 4.490 1.00 0.00 C ATOM 1678 C LEU A 735 -11.051 -4.445 5.538 1.00 0.00 C ATOM 1679 O LEU A 735 -10.579 -4.127 6.629 1.00 0.00 O ATOM 1680 CB LEU A 735 -12.878 -3.071 4.536 1.00 0.00 C ATOM 1681 CG LEU A 735 -13.234 -2.494 5.907 1.00 0.00 C ATOM 1682 CD1 LEU A 735 -12.658 -1.084 6.035 1.00 0.00 C ATOM 1683 CD2 LEU A 735 -14.756 -2.438 6.052 1.00 0.00 C ATOM 0 H LEU A 735 -11.795 -3.961 2.512 1.00 0.00 H new ATOM 0 HA LEU A 735 -10.816 -2.483 4.706 1.00 0.00 H new ATOM 0 HB2 LEU A 735 -13.133 -2.358 3.752 1.00 0.00 H new ATOM 0 HB3 LEU A 735 -13.459 -3.974 4.347 1.00 0.00 H new ATOM 0 HG LEU A 735 -12.815 -3.127 6.689 1.00 0.00 H new ATOM 0 HD11 LEU A 735 -12.913 -0.674 7.012 1.00 0.00 H new ATOM 0 HD12 LEU A 735 -11.574 -1.123 5.929 1.00 0.00 H new ATOM 0 HD13 LEU A 735 -13.076 -0.448 5.255 1.00 0.00 H new ATOM 0 HD21 LEU A 735 -15.014 -2.027 7.028 1.00 0.00 H new ATOM 0 HD22 LEU A 735 -15.173 -1.804 5.270 1.00 0.00 H new ATOM 0 HD23 LEU A 735 -15.167 -3.443 5.961 1.00 0.00 H new ATOM 1695 N THR A 736 -11.298 -5.707 5.193 1.00 0.00 N ATOM 1696 CA THR A 736 -11.017 -6.808 6.107 1.00 0.00 C ATOM 1697 C THR A 736 -9.539 -6.827 6.480 1.00 0.00 C ATOM 1698 O THR A 736 -9.178 -7.074 7.630 1.00 0.00 O ATOM 1699 CB THR A 736 -11.392 -8.140 5.453 1.00 0.00 C ATOM 1700 OG1 THR A 736 -12.751 -8.100 5.041 1.00 0.00 O ATOM 1701 CG2 THR A 736 -11.191 -9.276 6.457 1.00 0.00 C ATOM 0 H THR A 736 -11.689 -5.990 4.294 1.00 0.00 H new ATOM 0 HA THR A 736 -11.610 -6.665 7.010 1.00 0.00 H new ATOM 0 HB THR A 736 -10.757 -8.310 4.584 1.00 0.00 H new ATOM 0 HG1 THR A 736 -12.836 -7.527 4.251 1.00 0.00 H new ATOM 0 HG21 THR A 736 -11.458 -10.225 5.991 1.00 0.00 H new ATOM 0 HG22 THR A 736 -10.147 -9.306 6.768 1.00 0.00 H new ATOM 0 HG23 THR A 736 -11.825 -9.108 7.328 1.00 0.00 H new ATOM 1709 N THR A 737 -8.689 -6.569 5.494 1.00 0.00 N ATOM 1710 CA THR A 737 -7.250 -6.561 5.723 1.00 0.00 C ATOM 1711 C THR A 737 -6.855 -5.460 6.705 1.00 0.00 C ATOM 1712 O THR A 737 -5.983 -5.657 7.551 1.00 0.00 O ATOM 1713 CB THR A 737 -6.515 -6.355 4.397 1.00 0.00 C ATOM 1714 OG1 THR A 737 -6.900 -7.371 3.481 1.00 0.00 O ATOM 1715 CG2 THR A 737 -5.005 -6.420 4.633 1.00 0.00 C ATOM 0 H THR A 737 -8.968 -6.364 4.535 1.00 0.00 H new ATOM 0 HA THR A 737 -6.969 -7.522 6.154 1.00 0.00 H new ATOM 0 HB THR A 737 -6.773 -5.379 3.985 1.00 0.00 H new ATOM 0 HG1 THR A 737 -7.818 -7.208 3.179 1.00 0.00 H new ATOM 0 HG21 THR A 737 -4.482 -6.273 3.688 1.00 0.00 H new ATOM 0 HG22 THR A 737 -4.712 -5.639 5.335 1.00 0.00 H new ATOM 0 HG23 THR A 737 -4.743 -7.394 5.045 1.00 0.00 H new ATOM 1723 N LEU A 738 -7.487 -4.296 6.578 1.00 0.00 N ATOM 1724 CA LEU A 738 -7.173 -3.171 7.456 1.00 0.00 C ATOM 1725 C LEU A 738 -7.520 -3.486 8.909 1.00 0.00 C ATOM 1726 O LEU A 738 -6.713 -3.259 9.810 1.00 0.00 O ATOM 1727 CB LEU A 738 -7.949 -1.931 7.005 1.00 0.00 C ATOM 1728 CG LEU A 738 -7.426 -0.699 7.749 1.00 0.00 C ATOM 1729 CD1 LEU A 738 -7.860 0.564 7.004 1.00 0.00 C ATOM 1730 CD2 LEU A 738 -7.988 -0.668 9.175 1.00 0.00 C ATOM 0 H LEU A 738 -8.211 -4.107 5.885 1.00 0.00 H new ATOM 0 HA LEU A 738 -6.101 -2.983 7.393 1.00 0.00 H new ATOM 0 HB2 LEU A 738 -7.840 -1.792 5.929 1.00 0.00 H new ATOM 0 HB3 LEU A 738 -9.013 -2.063 7.203 1.00 0.00 H new ATOM 0 HG LEU A 738 -6.338 -0.745 7.796 1.00 0.00 H new ATOM 0 HD11 LEU A 738 -7.489 1.443 7.531 1.00 0.00 H new ATOM 0 HD12 LEU A 738 -7.452 0.548 5.993 1.00 0.00 H new ATOM 0 HD13 LEU A 738 -8.948 0.602 6.956 1.00 0.00 H new ATOM 0 HD21 LEU A 738 -7.610 0.212 9.696 1.00 0.00 H new ATOM 0 HD22 LEU A 738 -9.077 -0.627 9.136 1.00 0.00 H new ATOM 0 HD23 LEU A 738 -7.677 -1.567 9.708 1.00 0.00 H new ATOM 1742 N GLN A 739 -8.720 -4.011 9.133 1.00 0.00 N ATOM 1743 CA GLN A 739 -9.150 -4.350 10.486 1.00 0.00 C ATOM 1744 C GLN A 739 -8.355 -5.536 11.023 1.00 0.00 C ATOM 1745 O GLN A 739 -8.256 -5.732 12.234 1.00 0.00 O ATOM 1746 CB GLN A 739 -10.646 -4.673 10.502 1.00 0.00 C ATOM 1747 CG GLN A 739 -10.925 -5.874 9.600 1.00 0.00 C ATOM 1748 CD GLN A 739 -12.427 -6.129 9.525 1.00 0.00 C ATOM 1749 OE1 GLN A 739 -12.872 -7.009 8.788 1.00 0.00 O ATOM 1750 NE2 GLN A 739 -13.240 -5.406 10.246 1.00 0.00 N ATOM 0 H GLN A 739 -9.406 -4.210 8.405 1.00 0.00 H new ATOM 0 HA GLN A 739 -8.966 -3.489 11.129 1.00 0.00 H new ATOM 0 HB2 GLN A 739 -10.970 -4.888 11.520 1.00 0.00 H new ATOM 0 HB3 GLN A 739 -11.218 -3.810 10.161 1.00 0.00 H new ATOM 0 HG2 GLN A 739 -10.528 -5.690 8.602 1.00 0.00 H new ATOM 0 HG3 GLN A 739 -10.416 -6.757 9.987 1.00 0.00 H new ATOM 0 HE21 GLN A 739 -12.870 -4.677 10.856 1.00 0.00 H new ATOM 0 HE22 GLN A 739 -14.246 -5.570 10.199 1.00 0.00 H new ATOM 1759 N GLY A 740 -7.794 -6.327 10.114 1.00 0.00 N ATOM 1760 CA GLY A 740 -7.014 -7.496 10.504 1.00 0.00 C ATOM 1761 C GLY A 740 -5.910 -7.117 11.485 1.00 0.00 C ATOM 1762 O GLY A 740 -5.142 -7.971 11.931 1.00 0.00 O ATOM 0 H GLY A 740 -7.864 -6.181 9.107 1.00 0.00 H new ATOM 0 HA2 GLY A 740 -7.669 -8.239 10.959 1.00 0.00 H new ATOM 0 HA3 GLY A 740 -6.576 -7.956 9.619 1.00 0.00 H new ATOM 1766 N LEU A 741 -5.835 -5.834 11.821 1.00 0.00 N ATOM 1767 CA LEU A 741 -4.820 -5.361 12.754 1.00 0.00 C ATOM 1768 C LEU A 741 -5.299 -5.528 14.195 1.00 0.00 C ATOM 1769 O LEU A 741 -4.558 -5.265 15.140 1.00 0.00 O ATOM 1770 CB LEU A 741 -4.482 -3.889 12.457 1.00 0.00 C ATOM 1771 CG LEU A 741 -5.189 -2.953 13.449 1.00 0.00 C ATOM 1772 CD1 LEU A 741 -4.363 -2.826 14.736 1.00 0.00 C ATOM 1773 CD2 LEU A 741 -5.341 -1.570 12.811 1.00 0.00 C ATOM 0 H LEU A 741 -6.458 -5.109 11.465 1.00 0.00 H new ATOM 0 HA LEU A 741 -3.917 -5.958 12.628 1.00 0.00 H new ATOM 0 HB2 LEU A 741 -3.404 -3.740 12.516 1.00 0.00 H new ATOM 0 HB3 LEU A 741 -4.783 -3.641 11.439 1.00 0.00 H new ATOM 0 HG LEU A 741 -6.169 -3.364 13.693 1.00 0.00 H new ATOM 0 HD11 LEU A 741 -4.874 -2.160 15.432 1.00 0.00 H new ATOM 0 HD12 LEU A 741 -4.248 -3.809 15.193 1.00 0.00 H new ATOM 0 HD13 LEU A 741 -3.380 -2.418 14.499 1.00 0.00 H new ATOM 0 HD21 LEU A 741 -5.842 -0.900 13.510 1.00 0.00 H new ATOM 0 HD22 LEU A 741 -4.356 -1.171 12.569 1.00 0.00 H new ATOM 0 HD23 LEU A 741 -5.933 -1.653 11.900 1.00 0.00 H new